[(2S)-2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-[[(2S)-2-(methoxycarbonylamino)-3,3-diphenyl-propanoyl]amino]hexyl] 2-(dimethylamino)ethanoate

Systemtic Name: [(2S)-2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-[[(2S)-2-(methoxycarbonylamino)-3,3-diphenyl-propanoyl]amino]hexyl] 2-(dimethylamino)ethanoate Openeye Name: [(2S)-2-[(4-aminophenyl)sulfonyl-isobutyl-amino]-6-[[(2S)-2-(methoxycarbonylamino)-3,3-diphenyl-propanoyl]amino]hexyl] 2-(dimethylamino)acetate CAS Name: 2-(dimethylamino)acetic acid [(2S)-2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-[[(2S)-2-(methoxycarbonylamino)-1-oxo-3,3-diphenylpropyl]amino]hexyl] ester IUPAC Name: [(2S)-2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-[[(2S)-2-(methoxycarbonylamino)-3,3-diphenylpropanoyl]amino]hexyl] 2-(dimethylamino)acetate Traditional Name: 2-(dimethylamino)acetic acid [(2S)-6-[[(2S)-2-(carbomethoxyamino)-3,3-diphenyl-propanoyl]amino]-2-[isobutyl(sulfanilyl)amino]hexyl] ester Formula: C37H51N5O7S MolecularWeight: 709.89514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(CCCCNC(=O)C(C(C1=CC=CC=C1)C2=CC=CC=C2)NC(=O)OC)COC(=O)CN(C)C)S(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CC(C)CN([C@@H](CCCCNC(=O)[C@H](C(C1=CC=CC=C1)C2=CC=CC=C2)NC(=O)OC)COC(=O)CN(C)C)S(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C37H51N5O7S/c1-27(2)24-42(50(46,47)32-21-19-30(38)20-22-32)31(26-49-33(43)25-41(3)4)18-12-13-23-39-36(44)35(40-37(45)48-5)34(28-14-8-6-9-15-28)29-16-10-7-11-17-29/h6-11,14-17,19-22,27,31,34-35H,12-13,18,23-26,38H2,1-5H3,(H,39,44)(H,40,45)/t31-,35-/m0/s1