1-cyclopropyl-3-(3-ethoxy-4-methylsulfanyl-1-benzothiophen-5-yl)propane-1,3-dione

Systemtic Name: 1-cyclopropyl-3-(3-ethoxy-4-methylsulfanyl-1-benzothiophen-5-yl)propane-1,3-dione Openeye Name: 1-cyclopropyl-3-(3-ethoxy-4-methylsulfanyl-benzothiophen-5-yl)propane-1,3-dione CAS Name: 1-cyclopropyl-3-[3-ethoxy-4-(methylthio)-1-benzothiophen-5-yl]propane-1,3-dione IUPAC Name: 1-cyclopropyl-3-(3-ethoxy-4-methylsulfanyl-1-benzothiophen-5-yl)propane-1,3-dione Traditional Name: 1-cyclopropyl-3-[3-ethoxy-4-(methylthio)benzothiophen-5-yl]propane-1,3-dione Formula: C17H18O3S2 MolecularWeight: 334.45302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CSC2=C1C(=C(C=C2)C(=O)CC(=O)C3CC3)SC

Isomeric SMILES

CCOC1=CSC2=C1C(=C(C=C2)C(=O)CC(=O)C3CC3)SC

InChI

InChI=1S/C17H18O3S2/c1-3-20-14-9-22-15-7-6-11(17(21-2)16(14)15)13(19)8-12(18)10-4-5-10/h6-7,9-10H,3-5,8H2,1-2H3