3-methyl-1-[4-(2-methylpropanoyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-1-[4-(2-methylpropanoyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-[4-(2-methylpropanoyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-[4-(2-methylpropanoyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(4-isobutyrylpiperazino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)C(=O)C(C)C)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)C(=O)C(C)C)C#N

InChI

InChI=1S/C21H23N5O/c1-14(2)21(27)25-10-8-24(9-11-25)19-12-15(3)16(13-22)20-23-17-6-4-5-7-18(17)26(19)20/h4-7,12,14H,8-11H2,1-3H3