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

Systemtic Name: N-butyl-2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-butyl-2-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-butyl-2-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-butyl-2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-butyl-2-[[2-(3,4-dimethoxyanilino)-2-keto-ethyl]thio]benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1SCC(=O)NC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1SCC(=O)NC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H26N2O4S/c1-4-5-12-22-21(25)16-8-6-7-9-19(16)28-14-20(24)23-15-10-11-17(26-2)18(13-15)27-3/h6-11,13H,4-5,12,14H2,1-3H3,(H,22,25)(H,23,24)