methyl N-[(2S)-3-(1H-indol-3-yl)-1-[[(5S)-5-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-6-oxidanyl-hexyl]amino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: methyl N-[(2S)-3-(1H-indol-3-yl)-1-[[(5S)-5-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-6-oxidanyl-hexyl]amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: methyl N-[(1S)-2-[[(5S)-6-hydroxy-5-[isobutyl(p-tolylsulfonyl)amino]hexyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[[(5S)-6-hydroxy-5-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]hexyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[(2S)-1-[[(5S)-6-hydroxy-5-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]hexyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[[(5S)-6-hydroxy-5-[isobutyl(tosyl)amino]hexyl]amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamic acid methyl ester Formula: C30H42N4O6S MolecularWeight: 586.74268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)C(CCCCNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OC)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)[C@@H](CCCCNC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)OC)CO

InChI

InChI=1S/C30H42N4O6S/c1-21(2)19-34(41(38,39)25-14-12-22(3)13-15-25)24(20-35)9-7-8-16-31-29(36)28(33-30(37)40-4)17-23-18-32-27-11-6-5-10-26(23)27/h5-6,10-15,18,21,24,28,32,35H,7-9,16-17,19-20H2,1-4H3,(H,31,36)(H,33,37)/t24-,28-/m0/s1