ethyl 2-chloranyl-5-[2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 2-chloranyl-5-[2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 5-[[2-[N-(benzenesulfonyl)-4-isopropyl-anilino]acetyl]amino]-2-chloro-benzoate CAS Name: 5-[[2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-1-oxoethyl]amino]-2-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 5-[[2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]acetyl]amino]-2-chlorobenzoate Traditional Name: 5-[[2-(N-besyl-4-isopropyl-anilino)acetyl]amino]-2-chloro-benzoic acid ethyl ester Formula: C26H27ClN2O5S MolecularWeight: 515.02098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C26H27ClN2O5S/c1-4-34-26(31)23-16-20(12-15-24(23)27)28-25(30)17-29(21-13-10-19(11-14-21)18(2)3)35(32,33)22-8-6-5-7-9-22/h5-16,18H,4,17H2,1-3H3,(H,28,30)