1-butyl-7-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2-sulfanylidene-5-(trifluoromethyl)-8H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 1-butyl-7-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2-sulfanylidene-5-(trifluoromethyl)-8H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 1-butyl-7-(4-oxocyclohexa-2,5-dien-1-ylidene)-2-thioxo-5-(trifluoromethyl)-8H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 1-butyl-7-(4-oxo-1-cyclohexa-2,5-dienylidene)-2-sulfanylidene-5-(trifluoromethyl)-8H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 1-butyl-7-(4-oxocyclohexa-2,5-dien-1-ylidene)-2-sulfanylidene-5-(trifluoromethyl)-8H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 1-butyl-7-(4-ketocyclohexa-2,5-dien-1-ylidene)-2-thioxo-5-(trifluoromethyl)-8H-pyrido[2,3-d]pyrimidin-4-one Formula: C18H16F3N3O2S MolecularWeight: 395.39875

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=CC(=C3C=CC(=O)C=C3)N2)C(F)(F)F)C(=O)NC1=S

Isomeric SMILES

CCCCN1C2=C(C(=CC(=C3C=CC(=O)C=C3)N2)C(F)(F)F)C(=O)NC1=S

InChI

InChI=1S/C18H16F3N3O2S/c1-2-3-8-24-15-14(16(26)23-17(24)27)12(18(19,20)21)9-13(22-15)10-4-6-11(25)7-5-10/h4-7,9,22H,2-3,8H2,1H3,(H,23,26,27)