3-(2-ethoxyphenyl)-2-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)-1-pyridin-2-ylsulfonyl-indole-5-carbonitrile

Systemtic Name: 3-(2-ethoxyphenyl)-2-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)-1-pyridin-2-ylsulfonyl-indole-5-carbonitrile Openeye Name: 3-(2-ethoxyphenyl)-2-oxo-3-[4-(4-pyridyl)piperazin-1-yl]-1-(2-pyridylsulfonyl)indoline-5-carbonitrile CAS Name: 3-(2-ethoxyphenyl)-2-oxo-3-(4-pyridin-4-yl-1-piperazinyl)-1-(2-pyridinylsulfonyl)-5-indolecarbonitrile IUPAC Name: 3-(2-ethoxyphenyl)-2-oxo-3-(4-pyridin-4-ylpiperazin-1-yl)-1-pyridin-2-ylsulfonylindole-5-carbonitrile Traditional Name: 2-keto-3-o-phenetyl-3-[4-(4-pyridyl)piperazino]-1-(2-pyridylsulfonyl)indoline-5-carbonitrile Formula: C31H28N6O4S MolecularWeight: 580.65682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2(C3=C(C=CC(=C3)C#N)N(C2=O)S(=O)(=O)C4=CC=CC=N4)N5CCN(CC5)C6=CC=NC=C6

Isomeric SMILES

CCOC1=CC=CC=C1C2(C3=C(C=CC(=C3)C#N)N(C2=O)S(=O)(=O)C4=CC=CC=N4)N5CCN(CC5)C6=CC=NC=C6

InChI

InChI=1S/C31H28N6O4S/c1-2-41-28-8-4-3-7-25(28)31(36-19-17-35(18-20-36)24-12-15-33-16-13-24)26-21-23(22-32)10-11-27(26)37(30(31)38)42(39,40)29-9-5-6-14-34-29/h3-16,21H,2,17-20H2,1H3