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

Systemtic Name: 5-(4-chloranyl-3-methyl-phenyl)-6-ethyl-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzyl-5-(4-chloro-3-methyl-phenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-chloro-3-methylphenyl)-6-ethyl-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-benzyl-5-(4-chloro-3-methylphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-benzyl-5-(4-chloro-3-methyl-phenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H19ClN2OS MolecularWeight: 394.91706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN2OS/c1-3-17-19(15-9-10-16(23)13(2)11-15)20-21(26)24-18(25-22(20)27-17)12-14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3,(H,24,25,26)