2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-phenylbutyl)benzamide

Systemtic Name: 2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-phenylbutyl)benzamide Openeye Name: 2-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]sulfanyl-N-(4-phenylbutyl)benzamide CAS Name: 2-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]thio]-N-(4-phenylbutyl)benzamide IUPAC Name: 2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(4-phenylbutyl)benzamide Traditional Name: 2-[[2-(3,4-dimethoxyanilino)-2-keto-ethyl]thio]-N-(4-phenylbutyl)benzamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)NCCCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)NCCCCC3=CC=CC=C3)OC

InChI

InChI=1S/C27H30N2O4S/c1-32-23-16-15-21(18-24(23)33-2)29-26(30)19-34-25-14-7-6-13-22(25)27(31)28-17-9-8-12-20-10-4-3-5-11-20/h3-7,10-11,13-16,18H,8-9,12,17,19H2,1-2H3,(H,28,31)(H,29,30)