3-methyl-2-(3-methylbutyl)-1-[[(1R)-1-phenylethyl]amino]pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-2-(3-methylbutyl)-1-[[(1R)-1-phenylethyl]amino]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-isopentyl-3-methyl-1-[[(1R)-1-phenylethyl]amino]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-2-(3-methylbutyl)-1-[[(1R)-1-phenylethyl]amino]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-2-(3-methylbutyl)-1-[[(1R)-1-phenylethyl]amino]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-isoamyl-3-methyl-1-[[(1R)-1-phenylethyl]amino]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C26H28N4 MolecularWeight: 396.52732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(C)C)NC(C)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(C)C)N[C@H](C)C4=CC=CC=C4)C#N

InChI

InChI=1S/C26H28N4/c1-17(2)14-15-21-18(3)22(16-27)26-29-23-12-8-9-13-24(23)30(26)25(21)28-19(4)20-10-6-5-7-11-20/h5-13,17,19,28H,14-15H2,1-4H3/t19-/m1/s1