1-[[(2S)-butan-2-yl]amino]-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[[(2S)-butan-2-yl]amino]-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-isopentyl-3-methyl-1-[[(1S)-1-methylpropyl]amino]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[[(2S)-butan-2-yl]amino]-3-methyl-2-(3-methylbutyl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[[(2S)-butan-2-yl]amino]-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-isoamyl-3-methyl-1-[[(1S)-1-methylpropyl]amino]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H28N4 MolecularWeight: 348.48452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CCC(C)C

Isomeric SMILES

CC[C@H](C)NC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CCC(C)C

InChI

InChI=1S/C22H28N4/c1-6-15(4)24-21-17(12-11-14(2)3)16(5)18(13-23)22-25-19-9-7-8-10-20(19)26(21)22/h7-10,14-15,24H,6,11-12H2,1-5H3/t15-/m0/s1