3-(4-fluorophenyl)-2-[(3-nitrophenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-[(3-nitrophenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(4-fluorophenyl)-2-[(3-nitrophenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 3-(4-fluorophenyl)-2-[(3-nitrophenyl)methylthio]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-(4-fluorophenyl)-2-[(3-nitrophenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(4-fluorophenyl)-2-[(3-nitrobenzyl)thio]thieno[3,2-d]pyrimidin-4-one Formula: C19H12FN3O3S2 MolecularWeight: 413.445283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)F)SC=C3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)F)SC=C3

InChI

InChI=1S/C19H12FN3O3S2/c20-13-4-6-14(7-5-13)22-18(24)17-16(8-9-27-17)21-19(22)28-11-12-2-1-3-15(10-12)23(25)26/h1-10H,11H2