3-(6-chloranyl-2-ethoxy-pyridin-3-yl)-2-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)-1-quinolin-8-ylsulfonyl-indole-5-carbonitrile

Systemtic Name: 3-(6-chloranyl-2-ethoxy-pyridin-3-yl)-2-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)-1-quinolin-8-ylsulfonyl-indole-5-carbonitrile Openeye Name: 3-(6-chloro-2-ethoxy-3-pyridyl)-2-oxo-3-[4-(4-pyridyl)piperazin-1-yl]-1-(8-quinolylsulfonyl)indoline-5-carbonitrile CAS Name: 3-(6-chloro-2-ethoxy-3-pyridinyl)-2-oxo-3-(4-pyridin-4-yl-1-piperazinyl)-1-(8-quinolinylsulfonyl)-5-indolecarbonitrile IUPAC Name: 3-(6-chloro-2-ethoxypyridin-3-yl)-2-oxo-3-(4-pyridin-4-ylpiperazin-1-yl)-1-quinolin-8-ylsulfonylindole-5-carbonitrile Traditional Name: 3-(6-chloro-2-ethoxy-3-pyridyl)-2-keto-3-[4-(4-pyridyl)piperazino]-1-(8-quinolylsulfonyl)indoline-5-carbonitrile Formula: C34H28ClN7O4S MolecularWeight: 666.14862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=N1)Cl)C2(C3=C(C=CC(=C3)C#N)N(C2=O)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)N6CCN(CC6)C7=CC=NC=C7

Isomeric SMILES

CCOC1=C(C=CC(=N1)Cl)C2(C3=C(C=CC(=C3)C#N)N(C2=O)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)N6CCN(CC6)C7=CC=NC=C7

InChI

InChI=1S/C34H28ClN7O4S/c1-2-46-32-26(9-11-30(35)39-32)34(41-19-17-40(18-20-41)25-12-15-37-16-13-25)27-21-23(22-36)8-10-28(27)42(33(34)43)47(44,45)29-7-3-5-24-6-4-14-38-31(24)29/h3-16,21H,2,17-20H2,1H3