5-(4-ethylphenyl)-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-ethylphenyl)-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzyl-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-ethylphenyl)-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-benzyl-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-benzyl-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2OS MolecularWeight: 346.44542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H18N2OS/c1-2-14-8-10-16(11-9-14)17-13-25-21-19(17)20(24)22-18(23-21)12-15-6-4-3-5-7-15/h3-11,13H,2,12H2,1H3,(H,22,23,24)