3-[4-(4-methylpiperazin-1-yl)carbonylpyridin-2-yl]-2-oxidanylidene-1,3-dihydroindole-5-carbonitrile hydrochloride

Systemtic Name: 3-[4-(4-methylpiperazin-1-yl)carbonylpyridin-2-yl]-2-oxidanylidene-1,3-dihydroindole-5-carbonitrile hydrochloride Openeye Name: 3-[4-(4-methylpiperazine-1-carbonyl)-2-pyridyl]-2-oxo-indoline-5-carbonitrile hydrochloride CAS Name: 3-[4-[(4-methyl-1-piperazinyl)-oxomethyl]-2-pyridinyl]-2-oxo-1,3-dihydroindole-5-carbonitrile hydrochloride IUPAC Name: 3-[4-(4-methylpiperazine-1-carbonyl)pyridin-2-yl]-2-oxo-1,3-dihydroindole-5-carbonitrile hydrochloride Traditional Name: 2-keto-3-[4-(4-methylpiperazine-1-carbonyl)-2-pyridyl]indoline-5-carbonitrile hydrochloride Formula: C20H20ClN5O2 MolecularWeight: 397.8581

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC(=NC=C2)C3C4=C(C=CC(=C4)C#N)NC3=O.Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC(=NC=C2)C3C4=C(C=CC(=C4)C#N)NC3=O.Cl

InChI

InChI=1S/C20H19N5O2.ClH/c1-24-6-8-25(9-7-24)20(27)14-4-5-22-17(11-14)18-15-10-13(12-21)2-3-16(15)23-19(18)26;/h2-5,10-11,18H,6-9H2,1H3,(H,23,26);1H