5,6-dimethyl-2-[(4-phenylphenyl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(4-phenylphenyl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-5,6-dimethyl-2-[(4-phenylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(4-phenylphenyl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-[(4-phenylphenyl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-5,6-dimethyl-2-[(4-phenylbenzyl)thio]thieno[2,3-d]pyrimidin-4-one Formula: C24H22N2OS2 MolecularWeight: 418.57428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)C4=CC=CC=C4)CC=C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)C4=CC=CC=C4)CC=C)C

InChI

InChI=1S/C24H22N2OS2/c1-4-14-26-23(27)21-16(2)17(3)29-22(21)25-24(26)28-15-18-10-12-20(13-11-18)19-8-6-5-7-9-19/h4-13H,1,14-15H2,2-3H3