N1-({[(Methylamino)carbonyl]amino}carbothioyl)-4-methylbenzamide

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Systematic / IUPAC Name: 4-Methyl-N-[(methylcarbamoyl)carbamothioyl]benzamide

ID: Reference4761

Other Names: 1-Methyl-4-{[({[(methylamino)carbonyl]amino}carbothioyl)amino]carbonyl}benzene;
Benzamide, 4-methyl-N-({[(methylamino)carbonyl]amino}thioxomethyl)-

Formula: C11H13N3O2S

Spectral Data

N1-({[(Methylamino)carbonyl]amino}carbothioyl)-4-methylbenzamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 5/10/2016 10:14:25 AM
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Identificators

InChI InChI=1S/C11H13N3O2S/c1-7-3-5-8(6-4-7)9(15)13-11(17)14-10(16)12-2/h3-6H,1-2H3,(H3,12,13,14,15,16,17)
InChI Key PUGVXCRHGFKHFM-UHFFFAOYSA-N
Canonical SMILES CC1=CC=C(C=C1)C(=O)NC(=S)NC(=O)NC
CAS
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Other Names 1-Methyl-4-{[({[(methylamino)carbonyl]amino}carbothioyl)amino]carbonyl}benzene;
Benzamide, 4-methyl-N-({[(methylamino)carbonyl]amino}thioxomethyl)-

In Other Databases

PubChem 2738040
ChemSpider 2019666