2-[(E)-2-(5-methylthiophen-2-yl)ethenyl]-4-oxidanylidene-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid

Systemtic Name: 2-[(E)-2-(5-methylthiophen-2-yl)ethenyl]-4-oxidanylidene-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid Openeye Name: 2-[(E)-2-(5-methyl-2-thienyl)vinyl]-4-oxo-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid CAS Name: 2-[(E)-2-(5-methyl-2-thiophenyl)ethenyl]-4-oxo-3-propyl-7-pyrido[1,2-a]pyrimidinecarboxylic acid IUPAC Name: 2-[(E)-2-(5-methylthiophen-2-yl)ethenyl]-4-oxo-3-propylpyrido[1,2-a]pyrimidine-7-carboxylic acid Traditional Name: 4-keto-2-[(E)-2-(5-methyl-2-thienyl)vinyl]-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)C=CC3=CC=C(S3)C

Isomeric SMILES

CCCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)/C=C/C3=CC=C(S3)C

InChI

InChI=1S/C19H18N2O3S/c1-3-4-15-16(9-8-14-7-5-12(2)25-14)20-17-10-6-13(19(23)24)11-21(17)18(15)22/h5-11H,3-4H2,1-2H3,(H,23,24)/b9-8+