propan-2-yl 4-[2-[phenylsulfonyl(1,3-thiazol-2-yl)amino]ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-[phenylsulfonyl(1,3-thiazol-2-yl)amino]ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-[benzenesulfonyl(thiazol-2-yl)amino]acetyl]amino]benzoate CAS Name: 4-[[2-[benzenesulfonyl(2-thiazolyl)amino]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[benzenesulfonyl(1,3-thiazol-2-yl)amino]acetyl]amino]benzoate Traditional Name: 4-[[2-[besyl(thiazol-2-yl)amino]acetyl]amino]benzoic acid isopropyl ester Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=NC=CS2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=NC=CS2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O5S2/c1-15(2)29-20(26)16-8-10-17(11-9-16)23-19(25)14-24(21-22-12-13-30-21)31(27,28)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3,(H,23,25)