2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-3-phenethyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-3-phenethyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-3-phenethyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-3-phenethyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-3-phenethylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-3-phenethyl-thieno[3,2-d]pyrimidin-4-one Formula: C24H22N2O3S2 MolecularWeight: 450.57308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC=C3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC=C3

InChI

InChI=1S/C24H22N2O3S2/c1-16(27)18-8-9-21(29-2)19(14-18)15-31-24-25-20-11-13-30-22(20)23(28)26(24)12-10-17-6-4-3-5-7-17/h3-9,11,13-14H,10,12,15H2,1-2H3