1-(1-adamantylamino)-2-[(4-chlorophenyl)methyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-(1-adamantylamino)-2-[(4-chlorophenyl)methyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(1-adamantylamino)-2-[(4-chlorophenyl)methyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(1-adamantylamino)-2-[(4-chlorophenyl)methyl]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(1-adamantylamino)-2-[(4-chlorophenyl)methyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(1-adamantylamino)-2-(4-chlorobenzyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C30H29ClN4 MolecularWeight: 481.03106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=C(C=C4)Cl)NC56CC7CC(C5)CC(C7)C6)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=C(C=C4)Cl)NC56CC7CC(C5)CC(C7)C6)C#N

InChI

InChI=1S/C30H29ClN4/c1-18-24(13-19-6-8-23(31)9-7-19)29(34-30-14-20-10-21(15-30)12-22(11-20)16-30)35-27-5-3-2-4-26(27)33-28(35)25(18)17-32/h2-9,20-22,34H,10-16H2,1H3