5-(4-methylphenyl)-3-phenethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-methylphenyl)-3-phenethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-phenethyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-3-phenethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-3-phenethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-phenethyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2OS MolecularWeight: 346.44542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCC4=CC=CC=C4

InChI

InChI=1S/C21H18N2OS/c1-15-7-9-17(10-8-15)18-13-25-20-19(18)21(24)23(14-22-20)12-11-16-5-3-2-4-6-16/h2-10,13-14H,11-12H2,1H3