2-(6-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(6-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-keto-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C21H23N4O4S+ MolecularWeight: 427.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC=C1)NC(=CC2=O)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=[N+]2C(=CC=C1)NC(=CC2=O)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H22N4O4S/c1-15-6-4-9-19-22-17(14-21(27)25(15)19)13-20(26)23-16-7-5-8-18(12-16)30(28,29)24-10-2-3-11-24/h4-9,12,14H,2-3,10-11,13H2,1H3,(H,23,26)/p+1