methyl 2-[(2R)-1-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-1-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[(2R)-1-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2R)-1-(4-cyano-3-methyl-1-pyrido[1,2-a]benzimidazolyl)-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-1-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2R)-1-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCNC(=O)C4CC(=O)OC)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCNC(=O)[C@H]4CC(=O)OC)C#N

InChI

InChI=1S/C20H19N5O3/c1-12-9-17(24-8-7-22-20(27)16(24)10-18(26)28-2)25-15-6-4-3-5-14(15)23-19(25)13(12)11-21/h3-6,9,16H,7-8,10H2,1-2H3,(H,22,27)/t16-/m1/s1