7-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-3-ethyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 7-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-3-ethyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 7-[[4-(4-chlorobenzoyl)phenyl]methyl]-3-ethyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 7-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methyl]-3-ethyl-2-(methylthio)-4-pyrrolo[2,3-d]pyrimidinone IUPAC Name: 7-[[4-(4-chlorobenzoyl)phenyl]methyl]-3-ethyl-2-methylsulfanylpyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 7-[4-(4-chlorobenzoyl)benzyl]-3-ethyl-2-(methylthio)pyrrolo[2,3-d]pyrimidin-4-one Formula: C23H20ClN3O2S MolecularWeight: 437.9418

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SC)N(C=C2)CC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SC)N(C=C2)CC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H20ClN3O2S/c1-3-27-22(29)19-12-13-26(21(19)25-23(27)30-2)14-15-4-6-16(7-5-15)20(28)17-8-10-18(24)11-9-17/h4-13H,3,14H2,1-2H3