2-[(3-fluorophenyl)methylsulfanyl]-3-(phenylmethyl)pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-(phenylmethyl)pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-benzyl-2-[(3-fluorophenyl)methylsulfanyl]pyrido[2,3-d]pyrimidin-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-3-(phenylmethyl)-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 3-benzyl-2-[(3-fluorophenyl)methylsulfanyl]pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-benzyl-2-[(3-fluorobenzyl)thio]pyrido[2,3-d]pyrimidin-4-one Formula: C21H16FN3OS MolecularWeight: 377.434643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(N=CC=C3)N=C2SCC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(N=CC=C3)N=C2SCC4=CC(=CC=C4)F

InChI

InChI=1S/C21H16FN3OS/c22-17-9-4-8-16(12-17)14-27-21-24-19-18(10-5-11-23-19)20(26)25(21)13-15-6-2-1-3-7-15/h1-12H,13-14H2