4-cyano-3-methyl-2-[3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propyl]pyrido[1,2-a]benzimidazol-1-olate

Systemtic Name: 4-cyano-3-methyl-2-[3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propyl]pyrido[1,2-a]benzimidazol-1-olate Openeye Name: 4-cyano-3-methyl-2-[3-(4-methylpiperazin-1-yl)-3-oxo-propyl]pyrido[1,2-a]benzimidazol-1-olate CAS Name: 4-cyano-3-methyl-2-[3-(4-methyl-1-piperazinyl)-3-oxopropyl]-1-pyrido[1,2-a]benzimidazololate IUPAC Name: 4-cyano-3-methyl-2-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]pyrido[1,2-a]benzimidazol-1-olate Traditional Name: 4-cyano-2-[3-keto-3-(4-methylpiperazino)propyl]-3-methyl-pyrido[1,2-a]benzimidazol-1-olate Formula: C21H22N5O2- MolecularWeight: 376.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)N4CCN(CC4)C)[O-])C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)N4CCN(CC4)C)[O-])C#N

InChI

InChI=1S/C21H23N5O2/c1-14-15(7-8-19(27)25-11-9-24(2)10-12-25)21(28)26-18-6-4-3-5-17(18)23-20(26)16(14)13-22/h3-6,28H,7-12H2,1-2H3/p-1