1-butyl-4-oxidanylidene-2-sulfanylidene-7-thiophen-2-yl-pyrido[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: 1-butyl-4-oxidanylidene-2-sulfanylidene-7-thiophen-2-yl-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: 1-butyl-4-oxo-7-(2-thienyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 1-butyl-4-oxo-2-sulfanylidene-7-thiophen-2-yl-5-pyrido[2,3-d]pyrimidinecarboxylate IUPAC Name: 1-butyl-4-oxo-2-sulfanylidene-7-thiophen-2-ylpyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 1-butyl-4-keto-7-(2-thienyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate Formula: C16H14N3O3S2- MolecularWeight: 360.43066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=CC(=N2)C3=CC=CS3)C(=O)[O-])C(=O)NC1=S

Isomeric SMILES

CCCCN1C2=C(C(=CC(=N2)C3=CC=CS3)C(=O)[O-])C(=O)NC1=S

InChI

InChI=1S/C16H15N3O3S2/c1-2-3-6-19-13-12(14(20)18-16(19)23)9(15(21)22)8-10(17-13)11-5-4-7-24-11/h4-5,7-8H,2-3,6H2,1H3,(H,21,22)(H,18,20,23)/p-1