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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C27H30N2O4S/c1-4-5-8-19-11-13-20(14-12-19)29-27(31)22-9-6-7-10-25(22)34-18-26(30)28-21-15-16-23(32-2)24(17-21)33-3/h6-7,9-17H,4-5,8,18H2,1-3H3,(H,28,30)(H,29,31)