methyl 2-[2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[3-[(2,5-dimethylphenyl)methylsulfonyl]-1-indolyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[3-(2,5-dimethylbenzyl)sulfonylindol-1-yl]acetyl]amino]benzoic acid methyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C27H26N2O5S/c1-18-12-13-19(2)20(14-18)17-35(32,33)25-15-29(24-11-7-5-9-22(24)25)16-26(30)28-23-10-6-4-8-21(23)27(31)34-3/h4-15H,16-17H2,1-3H3,(H,28,30)