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

Systemtic Name: 3-methyl-2-(3-methylbutyl)-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-isopentyl-3-methyl-1-[4-(1-naphthylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-2-(3-methylbutyl)-1-[4-(1-naphthalenylmethyl)-1-piperazinyl]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-2-(3-methylbutyl)-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-isoamyl-3-methyl-1-[4-(1-naphthylmethyl)piperazino]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C33H35N5 MolecularWeight: 501.6645

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(C)C)N4CCN(CC4)CC5=CC=CC6=CC=CC=C65)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(C)C)N4CCN(CC4)CC5=CC=CC6=CC=CC=C65)C#N

InChI

InChI=1S/C33H35N5/c1-23(2)15-16-27-24(3)29(21-34)32-35-30-13-6-7-14-31(30)38(32)33(27)37-19-17-36(18-20-37)22-26-11-8-10-25-9-4-5-12-28(25)26/h4-14,23H,15-20,22H2,1-3H3