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

Systemtic Name: 2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-5,6-dimethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(6-chloro-3-pyridyl)methylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6-chloro-3-pyridinyl)methylthio]-5,6-dimethyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6-chloropyridin-3-yl)methylsulfanyl]-5,6-dimethyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(6-chloro-3-pyridyl)methylthio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C17H16ClN3OS2 MolecularWeight: 377.91144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3OS2/c1-4-7-21-16(22)14-10(2)11(3)24-15(14)20-17(21)23-9-12-5-6-13(18)19-8-12/h4-6,8H,1,7,9H2,2-3H3