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

Systemtic Name: 3-(2-ethoxyphenyl)-1-(5-methylpyridin-2-yl)sulfonyl-2-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)indole-5-carbonitrile Openeye Name: 3-(2-ethoxyphenyl)-1-[(5-methyl-2-pyridyl)sulfonyl]-2-oxo-3-[4-(4-pyridyl)piperazin-1-yl]indoline-5-carbonitrile CAS Name: 3-(2-ethoxyphenyl)-1-[(5-methyl-2-pyridinyl)sulfonyl]-2-oxo-3-(4-pyridin-4-yl-1-piperazinyl)-5-indolecarbonitrile IUPAC Name: 3-(2-ethoxyphenyl)-1-(5-methylpyridin-2-yl)sulfonyl-2-oxo-3-(4-pyridin-4-ylpiperazin-1-yl)indole-5-carbonitrile Traditional Name: 2-keto-1-[(5-methyl-2-pyridyl)sulfonyl]-3-o-phenetyl-3-[4-(4-pyridyl)piperazino]indoline-5-carbonitrile Formula: C32H30N6O4S MolecularWeight: 594.6834

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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=NC=C(C=C4)C)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=NC=C(C=C4)C)N5CCN(CC5)C6=CC=NC=C6

InChI

InChI=1S/C32H30N6O4S/c1-3-42-29-7-5-4-6-26(29)32(37-18-16-36(17-19-37)25-12-14-34-15-13-25)27-20-24(21-33)9-10-28(27)38(31(32)39)43(40,41)30-11-8-23(2)22-35-30/h4-15,20,22H,3,16-19H2,1-2H3