2-oxidanylidene-3-[5-[4-(phenylmethyl)piperazin-1-yl]sulfonylpyridin-2-yl]-1,3-dihydroindole-5-carbonitrile hydrochloride

Systemtic Name: 2-oxidanylidene-3-[5-[4-(phenylmethyl)piperazin-1-yl]sulfonylpyridin-2-yl]-1,3-dihydroindole-5-carbonitrile hydrochloride Openeye Name: 3-[5-(4-benzylpiperazin-1-yl)sulfonyl-2-pyridyl]-2-oxo-indoline-5-carbonitrile hydrochloride CAS Name: 2-oxo-3-[5-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-2-pyridinyl]-1,3-dihydroindole-5-carbonitrile hydrochloride IUPAC Name: 3-[5-(4-benzylpiperazin-1-yl)sulfonylpyridin-2-yl]-2-oxo-1,3-dihydroindole-5-carbonitrile hydrochloride Traditional Name: 3-[5-(4-benzylpiperazino)sulfonyl-2-pyridyl]-2-keto-indoline-5-carbonitrile hydrochloride Formula: C25H24ClN5O3S MolecularWeight: 510.00776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CN=C(C=C3)C4C5=C(C=CC(=C5)C#N)NC4=O.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CN=C(C=C3)C4C5=C(C=CC(=C5)C#N)NC4=O.Cl

InChI

InChI=1S/C25H23N5O3S.ClH/c26-15-19-6-8-22-21(14-19)24(25(31)28-22)23-9-7-20(16-27-23)34(32,33)30-12-10-29(11-13-30)17-18-4-2-1-3-5-18;/h1-9,14,16,24H,10-13,17H2,(H,28,31);1H