(1S,2S,3S)-N-[(2S)-1-[[(2S,3R,4S)-1-cyclohexyl-6-methyl-3,4-bis(oxidanyl)heptan-2-yl]amino]-1-oxidanylidene-3-(1,3-thiazol-4-yl)propan-2-yl]-2-morpholin-4-ylcarbonyl-3-phenyl-cyclopropane-1-carboxamide

Systemtic Name: (1S,2S,3S)-N-[(2S)-1-[[(2S,3R,4S)-1-cyclohexyl-6-methyl-3,4-bis(oxidanyl)heptan-2-yl]amino]-1-oxidanylidene-3-(1,3-thiazol-4-yl)propan-2-yl]-2-morpholin-4-ylcarbonyl-3-phenyl-cyclopropane-1-carboxamide Openeye Name: (1S,2S,3S)-N-[(1S)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexyl]amino]-2-oxo-1-(thiazol-4-ylmethyl)ethyl]-2-(morpholine-4-carbonyl)-3-phenyl-cyclopropanecarboxamide CAS Name: (1S,2S,3S)-N-[(2S)-1-[[(2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl]amino]-1-oxo-3-(4-thiazolyl)propan-2-yl]-2-[4-morpholinyl(oxo)methyl]-3-phenyl-1-cyclopropanecarboxamide IUPAC Name: (1S,2S,3S)-N-[(2S)-1-[[(2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl]amino]-1-oxo-3-(1,3-thiazol-4-yl)propan-2-yl]-2-(morpholine-4-carbonyl)-3-phenylcyclopropane-1-carboxamide Traditional Name: (1S,2S,3S)-N-[(1S)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexyl]amino]-2-keto-1-(thiazol-4-ylmethyl)ethyl]-2-(morpholine-4-carbonyl)-3-phenyl-cyclopropanecarboxamide Formula: C35H50N4O6S MolecularWeight: 654.8597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(CC1CCCCC1)NC(=O)C(CC2=CSC=N2)NC(=O)C3C(C3C(=O)N4CCOCC4)C5=CC=CC=C5)O)O

Isomeric SMILES

CC(C)C[C@@H]([C@@H]([C@H](CC1CCCCC1)NC(=O)[C@H](CC2=CSC=N2)NC(=O)[C@H]3[C@@H]([C@@H]3C(=O)N4CCOCC4)C5=CC=CC=C5)O)O

InChI

InChI=1S/C35H50N4O6S/c1-22(2)17-28(40)32(41)26(18-23-9-5-3-6-10-23)37-33(42)27(19-25-20-46-21-36-25)38-34(43)30-29(24-11-7-4-8-12-24)31(30)35(44)39-13-15-45-16-14-39/h4,7-8,11-12,20-23,26-32,40-41H,3,5-6,9-10,13-19H2,1-2H3,(H,37,42)(H,38,43)/t26-,27-,28-,29-,30-,31-,32+/m0/s1