ethyl 2-methyl-3-[2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 2-methyl-3-[2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[N-(benzenesulfonyl)-4-isopropyl-anilino]acetyl]amino]-2-methyl-benzoate CAS Name: 3-[[2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-1-oxoethyl]amino]-2-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]acetyl]amino]-2-methylbenzoate Traditional Name: 3-[[2-(N-besyl-4-isopropyl-anilino)acetyl]amino]-2-methyl-benzoic acid ethyl ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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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)C

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)C

InChI

InChI=1S/C27H30N2O5S/c1-5-34-27(31)24-12-9-13-25(20(24)4)28-26(30)18-29(22-16-14-21(15-17-22)19(2)3)35(32,33)23-10-7-6-8-11-23/h6-17,19H,5,18H2,1-4H3,(H,28,30)