1-[butyl(thiophen-2-ylmethyl)amino]-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[butyl(thiophen-2-ylmethyl)amino]-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-benzyl-1-[butyl(2-thienylmethyl)amino]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[butyl(thiophen-2-ylmethyl)amino]-3-methyl-2-(phenylmethyl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-benzyl-1-[butyl(thiophen-2-ylmethyl)amino]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-benzyl-1-[butyl(2-thenyl)amino]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C29H28N4S MolecularWeight: 464.62442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CS1)C2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5

Isomeric SMILES

CCCCN(CC1=CC=CS1)C2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N4S/c1-3-4-16-32(20-23-13-10-17-34-23)29-24(18-22-11-6-5-7-12-22)21(2)25(19-30)28-31-26-14-8-9-15-27(26)33(28)29/h5-15,17H,3-4,16,18,20H2,1-2H3