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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4S/c1-5-23(6-2)21(25)16-9-7-8-10-19(16)28-14-20(24)22-15-11-12-17(26-3)18(13-15)27-4/h7-13H,5-6,14H2,1-4H3,(H,22,24)