N-[(3-chlorophenyl)carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[(3-chlorophenyl)carbamothioyl]-3-methyl-butanamide Openeye Name: N-[(3-chlorophenyl)carbamothioyl]-3-methyl-butanamide CAS Name: N-[(3-chloroanilino)-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[(3-chlorophenyl)carbamothioyl]-3-methylbutanamide Traditional Name: N-[(3-chlorophenyl)thiocarbamoyl]-3-methyl-butyramide Formula: C12H15ClN2OS MolecularWeight: 270.7783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC(=CC=C1)Cl

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC(=CC=C1)Cl

InChI

InChI=1S/C12H15ClN2OS/c1-8(2)6-11(16)15-12(17)14-10-5-3-4-9(13)7-10/h3-5,7-8H,6H2,1-2H3,(H2,14,15,16,17)