N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]sulfonyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]sulfonyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-[2-oxo-2-(1-piperidyl)ethyl]indol-3-yl]sulfonyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[1-[2-oxo-2-(1-piperidinyl)ethyl]-3-indolyl]sulfonyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]sulfonylacetamide Traditional Name: N-homoveratryl-2-[1-(2-keto-2-piperidino-ethyl)indol-3-yl]sulfonyl-acetamide Formula: C27H33N3O6S MolecularWeight: 527.63242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCCCC4)OC

InChI

InChI=1S/C27H33N3O6S/c1-35-23-11-10-20(16-24(23)36-2)12-13-28-26(31)19-37(33,34)25-17-30(22-9-5-4-8-21(22)25)18-27(32)29-14-6-3-7-15-29/h4-5,8-11,16-17H,3,6-7,12-15,18-19H2,1-2H3,(H,28,31)