3-[(5-chloranyl-2-methoxy-phenyl)methyl]-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)methyl]-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(5-chloro-2-methoxy-phenyl)methyl]-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(5-chloro-2-methoxyphenyl)methyl]-6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(5-chloro-2-methoxyphenyl)methyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(5-chloro-2-methoxy-benzyl)-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H17ClN2O2S MolecularWeight: 396.88988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CC3=C(C=CC(=C3)Cl)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC3=C(C=CC(=C3)Cl)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H17ClN2O2S/c1-13-18(14-6-4-3-5-7-14)19-20(27-13)23-12-24(21(19)25)11-15-10-16(22)8-9-17(15)26-2/h3-10,12H,11H2,1-2H3