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

Systemtic Name: 5-(4-chloranyl-3-methyl-phenyl)-6-ethyl-2-[(4-methoxyphenyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-chloro-3-methyl-phenyl)-6-ethyl-2-[(4-methoxyphenyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-chloro-3-methylphenyl)-6-ethyl-2-[(4-methoxyphenyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-chloro-3-methylphenyl)-6-ethyl-2-[(4-methoxyphenyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-chloro-3-methyl-phenyl)-6-ethyl-2-p-anisyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H21ClN2O2S MolecularWeight: 424.94304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=C(NC2=O)CC3=CC=C(C=C3)OC)C4=CC(=C(C=C4)Cl)C

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(NC2=O)CC3=CC=C(C=C3)OC)C4=CC(=C(C=C4)Cl)C

InChI

InChI=1S/C23H21ClN2O2S/c1-4-18-20(15-7-10-17(24)13(2)11-15)21-22(27)25-19(26-23(21)29-18)12-14-5-8-16(28-3)9-6-14/h5-11H,4,12H2,1-3H3,(H,25,26,27)