(1S,4S,5R)-N-[4-azanyl-1-cyclobutyl-3,4-bis(oxidanylidene)butan-2-yl]-3-[(2S)-2-[[(2S)-3,3-dimethyl-1-[methyl(methylsulfonyl)amino]butan-2-yl]carbamoylamino]-2-(1-methylcyclohexyl)ethanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide

Systemtic Name: (1S,4S,5R)-N-[4-azanyl-1-cyclobutyl-3,4-bis(oxidanylidene)butan-2-yl]-3-[(2S)-2-[[(2S)-3,3-dimethyl-1-[methyl(methylsulfonyl)amino]butan-2-yl]carbamoylamino]-2-(1-methylcyclohexyl)ethanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide Openeye Name: (1S,4S,5R)-N-[3-amino-1-(cyclobutylmethyl)-2,3-dioxo-propyl]-3-[(2S)-2-[[(1S)-2,2-dimethyl-1-[[methyl(methylsulfonyl)amino]methyl]propyl]carbamoylamino]-2-(1-methylcyclohexyl)acetyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide CAS Name: (1S,4S,5R)-N-(4-amino-1-cyclobutyl-3,4-dioxobutan-2-yl)-3-[(2S)-2-[[[[(2S)-3,3-dimethyl-1-[methyl(methylsulfonyl)amino]butan-2-yl]amino]-oxomethyl]amino]-2-(1-methylcyclohexyl)-1-oxoethyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide IUPAC Name: (1S,4S,5R)-N-(4-amino-1-cyclobutyl-3,4-dioxobutan-2-yl)-3-[(2S)-2-[[(2S)-3,3-dimethyl-1-[methyl(methylsulfonyl)amino]butan-2-yl]carbamoylamino]-2-(1-methylcyclohexyl)acetyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide Traditional Name: (1S,4S,5R)-N-[3-amino-1-(cyclobutylmethyl)-2,3-diketo-propyl]-3-[(2S)-2-[[(1S)-1-[[mesyl(methyl)amino]methyl]-2,2-dimethyl-propyl]carbamoylamino]-2-(1-methylcyclohexyl)acetyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide Formula: C34H58N6O7S MolecularWeight: 694.92532

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C1C(N(C2)C(=O)C(C3(CCCCC3)C)NC(=O)NC(CN(C)S(=O)(=O)C)C(C)(C)C)C(=O)NC(CC4CCC4)C(=O)C(=O)N)C

Isomeric SMILES

CC1([C@@H]2[C@H]1[C@H](N(C2)C(=O)[C@H](C3(CCCCC3)C)NC(=O)N[C@H](CN(C)S(=O)(=O)C)C(C)(C)C)C(=O)NC(CC4CCC4)C(=O)C(=O)N)C

InChI

InChI=1S/C34H58N6O7S/c1-32(2,3)23(19-39(7)48(8,46)47)37-31(45)38-27(34(6)15-10-9-11-16-34)30(44)40-18-21-24(33(21,4)5)25(40)29(43)36-22(26(41)28(35)42)17-20-13-12-14-20/h20-25,27H,9-19H2,1-8H3,(H2,35,42)(H,36,43)(H2,37,38,45)/t21-,22?,23+,24-,25-,27+/m0/s1