N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(isopropylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzamide Traditional Name: N-homoveratryl-2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H28N2O4S/c1-15(2)24-21(25)14-29-20-8-6-5-7-17(20)22(26)23-12-11-16-9-10-18(27-3)19(13-16)28-4/h5-10,13,15H,11-12,14H2,1-4H3,(H,23,26)(H,24,25)