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

Systemtic Name: 3-methyl-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-[4-(3-thienylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-[4-(3-thiophenylmethyl)-1-piperazinyl]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-[4-(3-thenyl)piperazino]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H21N5S MolecularWeight: 387.50064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)CC5=CSC=C5)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)CC5=CSC=C5)C#N

InChI

InChI=1S/C22H21N5S/c1-16-12-21(26-9-7-25(8-10-26)14-17-6-11-28-15-17)27-20-5-3-2-4-19(20)24-22(27)18(16)13-23/h2-6,11-12,15H,7-10,14H2,1H3