(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-thiophen-2-ylpropanoate

Systemtic Name: (9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-thiophen-2-ylpropanoate Openeye Name: (9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(2-thienyl)propanoate CAS Name: 3-thiophen-2-ylpropanoic acid (9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)propionic acid (4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)CCC3=CC=CS3

Isomeric SMILES

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)CCC3=CC=CS3

InChI

InChI=1S/C17H16N2O3S/c1-12-4-2-8-19-15(20)10-13(18-17(12)19)11-22-16(21)7-6-14-5-3-9-23-14/h2-5,8-10H,6-7,11H2,1H3