5-carbamothioyl-3-[(3-methylphenyl)amino]pyrazine-2-carboxamide

Systemtic Name: 5-carbamothioyl-3-[(3-methylphenyl)amino]pyrazine-2-carboxamide Openeye Name: 5-carbamothioyl-3-(3-methylanilino)pyrazine-2-carboxamide CAS Name: 5-carbamothioyl-3-(3-methylanilino)-2-pyrazinecarboxamide IUPAC Name: 5-carbamothioyl-3-(3-methylanilino)pyrazine-2-carboxamide Traditional Name: 3-(m-toluidino)-5-thiocarbamoyl-pyrazinamide Formula: C13H13N5OS MolecularWeight: 287.34022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N5OS/c1-7-3-2-4-8(5-7)17-13-10(11(14)19)16-6-9(18-13)12(15)20/h2-6H,1H3,(H2,14,19)(H2,15,20)(H,17,18)