6-(4-methylphenyl)-2-(oxolan-2-ylmethylsulfanyl)-3-(phenylmethyl)thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 6-(4-methylphenyl)-2-(oxolan-2-ylmethylsulfanyl)-3-(phenylmethyl)thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-benzyl-6-(p-tolyl)-2-(tetrahydrofuran-2-ylmethylsulfanyl)thieno[3,2-d]pyrimidin-4-one CAS Name: 6-(4-methylphenyl)-2-(2-oxolanylmethylthio)-3-(phenylmethyl)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-benzyl-6-(4-methylphenyl)-2-(oxolan-2-ylmethylsulfanyl)thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-benzyl-6-(p-tolyl)-2-(tetrahydrofurfurylthio)thieno[3,2-d]pyrimidin-4-one Formula: C25H24N2O2S2 MolecularWeight: 448.60026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(S2)C(=O)N(C(=N3)SCC4CCCO4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(S2)C(=O)N(C(=N3)SCC4CCCO4)CC5=CC=CC=C5

InChI

InChI=1S/C25H24N2O2S2/c1-17-9-11-19(12-10-17)22-14-21-23(31-22)24(28)27(15-18-6-3-2-4-7-18)25(26-21)30-16-20-8-5-13-29-20/h2-4,6-7,9-12,14,20H,5,8,13,15-16H2,1H3