8-(3-piperazin-1-ylpyrrolo[3,2-b]pyridin-1-yl)sulfonyl-1H-quinolin-2-one

Systemtic Name: 8-(3-piperazin-1-ylpyrrolo[3,2-b]pyridin-1-yl)sulfonyl-1H-quinolin-2-one Openeye Name: 8-(3-piperazin-1-ylpyrrolo[3,2-b]pyridin-1-yl)sulfonyl-1H-quinolin-2-one CAS Name: 8-[[3-(1-piperazinyl)-1-pyrrolo[3,2-b]pyridinyl]sulfonyl]-1H-quinolin-2-one IUPAC Name: 8-(3-piperazin-1-ylpyrrolo[3,2-b]pyridin-1-yl)sulfonyl-1H-quinolin-2-one Traditional Name: 8-(3-piperazinopyrrolo[3,2-b]pyridin-1-yl)sulfonylcarbostyril Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CN(C3=C2N=CC=C3)S(=O)(=O)C4=CC=CC5=C4NC(=O)C=C5

Isomeric SMILES

C1CN(CCN1)C2=CN(C3=C2N=CC=C3)S(=O)(=O)C4=CC=CC5=C4NC(=O)C=C5

InChI

InChI=1S/C20H19N5O3S/c26-18-7-6-14-3-1-5-17(19(14)23-18)29(27,28)25-13-16(24-11-9-21-10-12-24)20-15(25)4-2-8-22-20/h1-8,13,21H,9-12H2,(H,23,26)