(3Z)-3-[5-[(4-methylpiperazin-1-yl)methyl]-1H-pyridin-2-ylidene]-2-oxidanylidene-1H-indole-6-carbonitrile hydrochloride

Systemtic Name: (3Z)-3-[5-[(4-methylpiperazin-1-yl)methyl]-1H-pyridin-2-ylidene]-2-oxidanylidene-1H-indole-6-carbonitrile hydrochloride Openeye Name: (3Z)-3-[5-[(4-methylpiperazin-1-yl)methyl]-1H-pyridin-2-ylidene]-2-oxo-indoline-6-carbonitrile hydrochloride CAS Name: (3Z)-3-[5-[(4-methyl-1-piperazinyl)methyl]-1H-pyridin-2-ylidene]-2-oxo-1H-indole-6-carbonitrile hydrochloride IUPAC Name: (3Z)-3-[5-[(4-methylpiperazin-1-yl)methyl]-1H-pyridin-2-ylidene]-2-oxo-1H-indole-6-carbonitrile hydrochloride Traditional Name: (3Z)-2-keto-3-[5-[(4-methylpiperazino)methyl]-1H-pyridin-2-ylidene]indoline-6-carbonitrile hydrochloride Formula: C20H22ClN5O MolecularWeight: 383.87458

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CNC(=C3C4=C(C=C(C=C4)C#N)NC3=O)C=C2.Cl

Isomeric SMILES

CN1CCN(CC1)CC2=CN/C(=C\3/C4=C(C=C(C=C4)C#N)NC3=O)/C=C2.Cl

InChI

InChI=1S/C20H21N5O.ClH/c1-24-6-8-25(9-7-24)13-15-3-5-17(22-12-15)19-16-4-2-14(11-21)10-18(16)23-20(19)26;/h2-5,10,12,22H,6-9,13H2,1H3,(H,23,26);1H/b19-17-;