3-(6-chloranyl-2-methoxy-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-methoxy-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-methoxy-3-pyridyl)-2-oxo-3-[4-(4-pyridyl)piperazin-1-yl]-1-(8-quinolylsulfonyl)indoline-5-carbonitrile CAS Name: 3-(6-chloro-2-methoxy-3-pyridinyl)-2-oxo-3-(4-pyridin-4-yl-1-piperazinyl)-1-(8-quinolinylsulfonyl)-5-indolecarbonitrile IUPAC Name: 3-(6-chloro-2-methoxypyridin-3-yl)-2-oxo-3-(4-pyridin-4-ylpiperazin-1-yl)-1-quinolin-8-ylsulfonylindole-5-carbonitrile Traditional Name: 3-(6-chloro-2-methoxy-3-pyridyl)-2-keto-3-[4-(4-pyridyl)piperazino]-1-(8-quinolylsulfonyl)indoline-5-carbonitrile Formula: C33H26ClN7O4S MolecularWeight: 652.12204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=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

COC1=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/C33H26ClN7O4S/c1-45-31-25(8-10-29(34)38-31)33(40-18-16-39(17-19-40)24-11-14-36-15-12-24)26-20-22(21-35)7-9-27(26)41(32(33)42)46(43,44)28-6-2-4-23-5-3-13-37-30(23)28/h2-15,20H,16-19H2,1H3