N-(3-chloranyl-2-methyl-phenyl)-4-[2-(2-methylpropanoylcarbamothioyl)hydrazinyl]-4-oxidanylidene-butanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-[2-(2-methylpropanoylcarbamothioyl)hydrazinyl]-4-oxidanylidene-butanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-[2-(2-methylpropanoylcarbamothioyl)hydrazino]-4-oxo-butanamide CAS Name: N-(3-chloro-2-methylphenyl)-4-[[[(2-methyl-1-oxopropyl)amino]-sulfanylidenemethyl]hydrazo]-4-oxobutanamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-[2-(2-methylpropanoylcarbamothioyl)hydrazinyl]-4-oxobutanamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-[N'-(isobutyrylthiocarbamoyl)hydrazino]-4-keto-butyramide Formula: C16H21ClN4O3S MolecularWeight: 384.88094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CCC(=O)NNC(=S)NC(=O)C(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CCC(=O)NNC(=S)NC(=O)C(C)C

InChI

InChI=1S/C16H21ClN4O3S/c1-9(2)15(24)19-16(25)21-20-14(23)8-7-13(22)18-12-6-4-5-11(17)10(12)3/h4-6,9H,7-8H2,1-3H3,(H,18,22)(H,20,23)(H2,19,21,24,25)