7-(4-bromophenyl)-1-butan-2-yl-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 7-(4-bromophenyl)-1-butan-2-yl-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Openeye Name: 7-(4-bromophenyl)-1-sec-butyl-2-thioxo-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one CAS Name: 7-(4-bromophenyl)-1-butan-2-yl-2-sulfanylidene-5-(trifluoromethyl)-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 7-(4-bromophenyl)-1-butan-2-yl-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Traditional Name: 7-(4-bromophenyl)-1-sec-butyl-2-thioxo-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Formula: C18H15BrF3N3OS MolecularWeight: 458.29541

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C(=CC(=N2)C3=CC=C(C=C3)Br)C(F)(F)F)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C2=C(C(=CC(=N2)C3=CC=C(C=C3)Br)C(F)(F)F)C(=O)NC1=S

InChI

InChI=1S/C18H15BrF3N3OS/c1-3-9(2)25-15-14(16(26)24-17(25)27)12(18(20,21)22)8-13(23-15)10-4-6-11(19)7-5-10/h4-9H,3H2,1-2H3,(H,24,26,27)