4-[3-[(2-chlorophenyl)methylamino]-3-oxidanylidene-propyl]sulfanyl-N-(2,6-dimethylphenyl)butanamide

Systemtic Name: 4-[3-[(2-chlorophenyl)methylamino]-3-oxidanylidene-propyl]sulfanyl-N-(2,6-dimethylphenyl)butanamide Openeye Name: 4-[3-[(2-chlorophenyl)methylamino]-3-oxo-propyl]sulfanyl-N-(2,6-dimethylphenyl)butanamide CAS Name: 4-[[3-[(2-chlorophenyl)methylamino]-3-oxopropyl]thio]-N-(2,6-dimethylphenyl)butanamide IUPAC Name: 4-[3-[(2-chlorophenyl)methylamino]-3-oxopropyl]sulfanyl-N-(2,6-dimethylphenyl)butanamide Traditional Name: 4-[[3-[(2-chlorobenzyl)amino]-3-keto-propyl]thio]-N-(2,6-dimethylphenyl)butyramide Formula: C22H27ClN2O2S MolecularWeight: 418.97998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSCCC(=O)NCC2=CC=CC=C2Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSCCC(=O)NCC2=CC=CC=C2Cl

InChI

InChI=1S/C22H27ClN2O2S/c1-16-7-5-8-17(2)22(16)25-21(27)11-6-13-28-14-12-20(26)24-15-18-9-3-4-10-19(18)23/h3-5,7-10H,6,11-15H2,1-2H3,(H,24,26)(H,25,27)