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

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(2,5-dimethylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(2,5-dimethylbenzyl)thio]thieno[2,3-d]pyrimidin-4-one Formula: C18H18N2OS2 MolecularWeight: 342.47832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC3=C(C=CS3)C(=O)N2CC=C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC3=C(C=CS3)C(=O)N2CC=C

InChI

InChI=1S/C18H18N2OS2/c1-4-8-20-17(21)15-7-9-22-16(15)19-18(20)23-11-14-10-12(2)5-6-13(14)3/h4-7,9-10H,1,8,11H2,2-3H3