1-butyl-7-(4-methoxyphenyl)-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 1-butyl-7-(4-methoxyphenyl)-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Openeye Name: 1-butyl-7-(4-methoxyphenyl)-2-thioxo-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one CAS Name: 1-butyl-7-(4-methoxyphenyl)-2-sulfanylidene-5-(trifluoromethyl)-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 1-butyl-7-(4-methoxyphenyl)-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Traditional Name: 1-butyl-7-(4-methoxyphenyl)-2-thioxo-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Formula: C19H18F3N3O2S MolecularWeight: 409.42533

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C(F)(F)F)C(=O)NC1=S

Isomeric SMILES

CCCCN1C2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C(F)(F)F)C(=O)NC1=S

InChI

InChI=1S/C19H18F3N3O2S/c1-3-4-9-25-16-15(17(26)24-18(25)28)13(19(20,21)22)10-14(23-16)11-5-7-12(27-2)8-6-11/h5-8,10H,3-4,9H2,1-2H3,(H,24,26,28)