(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(methylsulfonylamino)benzoate

Systemtic Name: (7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(methylsulfonylamino)benzoate Openeye Name: (7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(methanesulfonamido)benzoate CAS Name: 3-(methanesulfonamido)benzoic acid (7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-(methanesulfonamido)benzoate Traditional Name: 3-(methanesulfonamido)benzoic acid (4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C18H17N3O5S MolecularWeight: 387.40968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)COC(=O)C3=CC(=CC=C3)NS(=O)(=O)C)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)COC(=O)C3=CC(=CC=C3)NS(=O)(=O)C)C=C1

InChI

InChI=1S/C18H17N3O5S/c1-12-6-7-16-19-15(9-17(22)21(16)10-12)11-26-18(23)13-4-3-5-14(8-13)20-27(2,24)25/h3-10,20H,11H2,1-2H3