5-cyclopropyl-3-phenyl-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-cyclopropyl-3-phenyl-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-5-cyclopropyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-cyclopropyl-3-phenyl-2-(phenylmethylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-benzylsulfanyl-5-cyclopropyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(benzylthio)-5-cyclopropyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H18N2OS2 MolecularWeight: 390.52112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C22H18N2OS2/c25-21-19-18(16-11-12-16)14-26-20(19)23-22(24(21)17-9-5-2-6-10-17)27-13-15-7-3-1-4-8-15/h1-10,14,16H,11-13H2