3-(1,3-benzodioxol-5-yl)-5-ethyl-6-methyl-2-methylsulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-6-methyl-2-methylsulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-6-methyl-2-methylsulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-6-methyl-2-(methylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-6-methyl-2-methylsulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-ethyl-6-methyl-2-(methylthio)thieno[2,3-d]pyrimidin-4-one Formula: C17H16N2O3S2 MolecularWeight: 360.45054

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SC)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SC)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C17H16N2O3S2/c1-4-11-9(2)24-15-14(11)16(20)19(17(18-15)23-3)10-5-6-12-13(7-10)22-8-21-12/h5-7H,4,8H2,1-3H3