1-methyl-4-[(4-methylphenyl)methylcarbamothioylamino]pyrazole-3-carboxamide

Systemtic Name: 1-methyl-4-[(4-methylphenyl)methylcarbamothioylamino]pyrazole-3-carboxamide Openeye Name: 1-methyl-4-(p-tolylmethylcarbamothioylamino)pyrazole-3-carboxamide CAS Name: 1-methyl-4-[[[(4-methylphenyl)methylamino]-sulfanylidenemethyl]amino]-3-pyrazolecarboxamide IUPAC Name: 1-methyl-4-[(4-methylphenyl)methylcarbamothioylamino]pyrazole-3-carboxamide Traditional Name: 1-methyl-4-[(4-methylbenzyl)thiocarbamoylamino]pyrazole-3-carboxamide Formula: C14H17N5OS MolecularWeight: 303.38268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC2=CN(N=C2C(=O)N)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC2=CN(N=C2C(=O)N)C

InChI

InChI=1S/C14H17N5OS/c1-9-3-5-10(6-4-9)7-16-14(21)17-11-8-19(2)18-12(11)13(15)20/h3-6,8H,7H2,1-2H3,(H2,15,20)(H2,16,17,21)