ethyl 2-[3-(phenylmethyl)sulfonylpropanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(phenylmethyl)sulfonylpropanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-(3-benzylsulfonylpropanoylamino)thiophene-3-carboxylate CAS Name: 2-[[1-oxo-3-(phenylmethyl)sulfonylpropyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-benzylsulfonylpropanoylamino)thiophene-3-carboxylate Traditional Name: 2-(3-benzylsulfonylpropanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C17H19NO5S2 MolecularWeight: 381.46646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C17H19NO5S2/c1-2-23-17(20)14-8-10-24-16(14)18-15(19)9-11-25(21,22)12-13-6-4-3-5-7-13/h3-8,10H,2,9,11-12H2,1H3,(H,18,19)