[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 4-[(5-chloranylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 4-[(5-chloranylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: [2-(benzylamino)-1-methyl-2-oxo-ethyl] 4-[(5-chloro-2-thienyl)sulfonylamino]benzoate CAS Name: 4-[(5-chloro-2-thiophenyl)sulfonylamino]benzoic acid [1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxopropan-2-yl] 4-[(5-chlorothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 4-[(5-chloro-2-thienyl)sulfonylamino]benzoic acid [2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H19ClN2O5S2 MolecularWeight: 478.96896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C21H19ClN2O5S2/c1-14(20(25)23-13-15-5-3-2-4-6-15)29-21(26)16-7-9-17(10-8-16)24-31(27,28)19-12-11-18(22)30-19/h2-12,14,24H,13H2,1H3,(H,23,25)