N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-butanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-butanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-butanamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]butanamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanylbutanamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[3-[(2-phenylacetyl)amino]phenyl]thio]butyramide Formula: C26H27ClN2O3S MolecularWeight: 483.02218

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C(=C1)C)Cl)OC)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C(=C1)C)Cl)OC)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C26H27ClN2O3S/c1-4-24(26(31)29-22-13-17(2)21(27)16-23(22)32-3)33-20-12-8-11-19(15-20)28-25(30)14-18-9-6-5-7-10-18/h5-13,15-16,24H,4,14H2,1-3H3,(H,28,30)(H,29,31)