N-[(2-chlorophenyl)methylcarbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[(2-chlorophenyl)methylcarbamothioyl]-3-methyl-butanamide Openeye Name: N-[(2-chlorophenyl)methylcarbamothioyl]-3-methyl-butanamide CAS Name: N-[[(2-chlorophenyl)methylamino]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[(2-chlorophenyl)methylcarbamothioyl]-3-methylbutanamide Traditional Name: N-[(2-chlorobenzyl)thiocarbamoyl]-3-methyl-butyramide Formula: C13H17ClN2OS MolecularWeight: 284.80488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NCC1=CC=CC=C1Cl

Isomeric SMILES

CC(C)CC(=O)NC(=S)NCC1=CC=CC=C1Cl

InChI

InChI=1S/C13H17ClN2OS/c1-9(2)7-12(17)16-13(18)15-8-10-5-3-4-6-11(10)14/h3-6,9H,7-8H2,1-2H3,(H2,15,16,17,18)