ethyl 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)propanoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H23NO5S2 MolecularWeight: 469.57312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C24H23NO5S2/c1-3-28-24(27)18-14-21(16-7-5-4-6-8-16)32-23(18)25-22(26)15(2)31-17-9-10-19-20(13-17)30-12-11-29-19/h4-10,13-15H,3,11-12H2,1-2H3,(H,25,26)