3-(2-ethoxy-5-methoxy-phenyl)-3-[4-(2-methylpyridin-4-yl)piperazin-1-yl]-1-(4-methylquinolin-8-yl)sulfonyl-2-oxidanylidene-indole-5-carbonitrile

Systemtic Name: 3-(2-ethoxy-5-methoxy-phenyl)-3-[4-(2-methylpyridin-4-yl)piperazin-1-yl]-1-(4-methylquinolin-8-yl)sulfonyl-2-oxidanylidene-indole-5-carbonitrile Openeye Name: 3-(2-ethoxy-5-methoxy-phenyl)-3-[4-(2-methyl-4-pyridyl)piperazin-1-yl]-1-[(4-methyl-8-quinolyl)sulfonyl]-2-oxo-indoline-5-carbonitrile CAS Name: 3-(2-ethoxy-5-methoxyphenyl)-3-[4-(2-methyl-4-pyridinyl)-1-piperazinyl]-1-[(4-methyl-8-quinolinyl)sulfonyl]-2-oxo-5-indolecarbonitrile IUPAC Name: 3-(2-ethoxy-5-methoxyphenyl)-3-[4-(2-methylpyridin-4-yl)piperazin-1-yl]-1-(4-methylquinolin-8-yl)sulfonyl-2-oxoindole-5-carbonitrile Traditional Name: 3-(2-ethoxy-5-methoxy-phenyl)-2-keto-3-[4-(2-methyl-4-pyridyl)piperazino]-1-[(4-methyl-8-quinolyl)sulfonyl]indoline-5-carbonitrile Formula: C38H36N6O5S MolecularWeight: 688.79464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)OC)C2(C3=C(C=CC(=C3)C#N)N(C2=O)S(=O)(=O)C4=CC=CC5=C(C=CN=C54)C)N6CCN(CC6)C7=CC(=NC=C7)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)OC)C2(C3=C(C=CC(=C3)C#N)N(C2=O)S(=O)(=O)C4=CC=CC5=C(C=CN=C54)C)N6CCN(CC6)C7=CC(=NC=C7)C

InChI

InChI=1S/C38H36N6O5S/c1-5-49-34-12-10-29(48-4)23-32(34)38(43-19-17-42(18-20-43)28-14-16-40-26(3)21-28)31-22-27(24-39)9-11-33(31)44(37(38)45)50(46,47)35-8-6-7-30-25(2)13-15-41-36(30)35/h6-16,21-23H,5,17-20H2,1-4H3