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

Systemtic Name: 3-(2-methoxypyridin-3-yl)-2-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)-1-quinolin-8-ylsulfonyl-indole-5-carbonitrile Openeye Name: 3-(2-methoxy-3-pyridyl)-2-oxo-3-[4-(4-pyridyl)piperazin-1-yl]-1-(8-quinolylsulfonyl)indoline-5-carbonitrile CAS Name: 3-(2-methoxy-3-pyridinyl)-2-oxo-3-(4-pyridin-4-yl-1-piperazinyl)-1-(8-quinolinylsulfonyl)-5-indolecarbonitrile IUPAC Name: 3-(2-methoxypyridin-3-yl)-2-oxo-3-(4-pyridin-4-ylpiperazin-1-yl)-1-quinolin-8-ylsulfonylindole-5-carbonitrile Traditional Name: 2-keto-3-(2-methoxy-3-pyridyl)-3-[4-(4-pyridyl)piperazino]-1-(8-quinolylsulfonyl)indoline-5-carbonitrile Formula: C33H27N7O4S MolecularWeight: 617.67698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)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

COC1=C(C=CC=N1)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/C33H27N7O4S/c1-44-31-26(7-4-14-37-31)33(39-19-17-38(18-20-39)25-11-15-35-16-12-25)27-21-23(22-34)9-10-28(27)40(32(33)41)45(42,43)29-8-2-5-24-6-3-13-36-30(24)29/h2-16,21H,17-20H2,1H3