tert-butyl (2S)-6-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]-2-(2,3-dihydro-1H-inden-2-ylamino)hexanoate

Systemtic Name: tert-butyl (2S)-6-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]-2-(2,3-dihydro-1H-inden-2-ylamino)hexanoate Openeye Name: tert-butyl (2S)-6-[(4-chloro-3-sulfamoyl-benzoyl)amino]-2-(indan-2-ylamino)hexanoate CAS Name: (2S)-6-[[(4-chloro-3-sulfamoylphenyl)-oxomethyl]amino]-2-(2,3-dihydro-1H-inden-2-ylamino)hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-6-[(4-chloro-3-sulfamoylbenzoyl)amino]-2-(2,3-dihydro-1H-inden-2-ylamino)hexanoate Traditional Name: (2S)-6-[(4-chloro-3-sulfamoyl-benzoyl)amino]-2-(indan-2-ylamino)hexanoic acid tert-butyl ester Formula: C26H34ClN3O5S MolecularWeight: 536.08326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N)NC2CC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CCCCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N)NC2CC3=CC=CC=C3C2

InChI

InChI=1S/C26H34ClN3O5S/c1-26(2,3)35-25(32)22(30-20-14-17-8-4-5-9-18(17)15-20)10-6-7-13-29-24(31)19-11-12-21(27)23(16-19)36(28,33)34/h4-5,8-9,11-12,16,20,22,30H,6-7,10,13-15H2,1-3H3,(H,29,31)(H2,28,33,34)/t22-/m0/s1