ethyl 2-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[4-(1-piperidylsulfonyl)benzoyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-piperidin-1-ylsulfonylbenzoyl)amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[(4-piperidinosulfonylbenzoyl)amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C23H24N2O5S2 MolecularWeight: 472.57706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H24N2O5S2/c1-2-30-23(27)20-18-8-4-5-9-19(18)31-22(20)24-21(26)16-10-12-17(13-11-16)32(28,29)25-14-6-3-7-15-25/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,24,26)