4-[[2-(4-chlorophenyl)sulfanylphenyl]methylamino]-2-methyl-butanamide

Systemtic Name: 4-[[2-(4-chlorophenyl)sulfanylphenyl]methylamino]-2-methyl-butanamide Openeye Name: 4-[[2-(4-chlorophenyl)sulfanylphenyl]methylamino]-2-methyl-butanamide CAS Name: 4-[[2-[(4-chlorophenyl)thio]phenyl]methylamino]-2-methylbutanamide IUPAC Name: 4-[[2-(4-chlorophenyl)sulfanylphenyl]methylamino]-2-methylbutanamide Traditional Name: 4-[[2-[(4-chlorophenyl)thio]benzyl]amino]-2-methyl-butyramide Formula: C18H21ClN2OS MolecularWeight: 348.89014

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNCC1=CC=CC=C1SC2=CC=C(C=C2)Cl)C(=O)N

Isomeric SMILES

CC(CCNCC1=CC=CC=C1SC2=CC=C(C=C2)Cl)C(=O)N

InChI

InChI=1S/C18H21ClN2OS/c1-13(18(20)22)10-11-21-12-14-4-2-3-5-17(14)23-16-8-6-15(19)7-9-16/h2-9,13,21H,10-12H2,1H3,(H2,20,22)