1-[4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-methyl-2-prop-2-enyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-methyl-2-prop-2-enyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-allyl-1-[4-[(5-chloro-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-[(5-chloro-2-methoxyphenyl)methyl]-1-piperazinyl]-3-methyl-2-prop-2-enyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-[(5-chloro-2-methoxyphenyl)methyl]piperazin-1-yl]-3-methyl-2-prop-2-enylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-allyl-1-[4-(5-chloro-2-methoxy-benzyl)piperazino]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C28H28ClN5O MolecularWeight: 486.00782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC=C)N4CCN(CC4)CC5=C(C=CC(=C5)Cl)OC)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC=C)N4CCN(CC4)CC5=C(C=CC(=C5)Cl)OC)C#N

InChI

InChI=1S/C28H28ClN5O/c1-4-7-22-19(2)23(17-30)27-31-24-8-5-6-9-25(24)34(27)28(22)33-14-12-32(13-15-33)18-20-16-21(29)10-11-26(20)35-3/h4-6,8-11,16H,1,7,12-15,18H2,2-3H3