N-(4-cyanophenyl)-2-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(4-cyanophenyl)-2-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]ethanamide Openeye Name: N-(4-cyanophenyl)-2-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]acetamide CAS Name: N-(4-cyanophenyl)-2-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]acetamide IUPAC Name: N-(4-cyanophenyl)-2-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]acetamide Traditional Name: N-(4-cyanophenyl)-2-[(4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]acetamide Formula: C19H17N4O2S+ MolecularWeight: 365.42888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSCC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSCC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H16N4O2S/c1-13-2-7-17-21-16(8-19(25)23(17)10-13)11-26-12-18(24)22-15-5-3-14(9-20)4-6-15/h2-8,10H,11-12H2,1H3,(H,22,24)/p+1