(4S)-3-[(2R)-2-[[1-(tert-butylsulfonylmethyl)cyclohexyl]carbamoylamino]-3,3-dimethyl-butanoyl]-N-[1-[2-(cyclopropylamino)-2-oxidanylidene-ethanoyl]cyclopropyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide

Systemtic Name: (4S)-3-[(2R)-2-[[1-(tert-butylsulfonylmethyl)cyclohexyl]carbamoylamino]-3,3-dimethyl-butanoyl]-N-[1-[2-(cyclopropylamino)-2-oxidanylidene-ethanoyl]cyclopropyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide Openeye Name: (4S)-3-[(2R)-2-[[1-(tert-butylsulfonylmethyl)cyclohexyl]carbamoylamino]-3,3-dimethyl-butanoyl]-N-[1-[2-(cyclopropylamino)-2-oxo-acetyl]cyclopropyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide CAS Name: (4S)-3-[(2R)-2-[[[[1-(tert-butylsulfonylmethyl)cyclohexyl]amino]-oxomethyl]amino]-3,3-dimethyl-1-oxobutyl]-N-[1-[2-(cyclopropylamino)-1,2-dioxoethyl]cyclopropyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide IUPAC Name: (4S)-3-[(2R)-2-[[1-(tert-butylsulfonylmethyl)cyclohexyl]carbamoylamino]-3,3-dimethylbutanoyl]-N-[1-[2-(cyclopropylamino)-2-oxoacetyl]cyclopropyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide Traditional Name: (4S)-3-[(2R)-2-[[1-(tert-butylsulfonylmethyl)cyclohexyl]carbamoylamino]-3,3-dimethyl-butanoyl]-N-[1-[2-(cyclopropylamino)-2-keto-acetyl]cyclopropyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide Formula: C34H55N5O7S MolecularWeight: 677.8948

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C1C(N(C2)C(=O)C(C(C)(C)C)NC(=O)NC3(CCCCC3)CS(=O)(=O)C(C)(C)C)C(=O)NC4(CC4)C(=O)C(=O)NC5CC5)C

Isomeric SMILES

CC1(C2C1[C@H](N(C2)C(=O)[C@@H](C(C)(C)C)NC(=O)NC3(CCCCC3)CS(=O)(=O)C(C)(C)C)C(=O)NC4(CC4)C(=O)C(=O)NC5CC5)C

InChI

InChI=1S/C34H55N5O7S/c1-30(2,3)24(36-29(44)38-33(14-10-9-11-15-33)19-47(45,46)31(4,5)6)28(43)39-18-21-22(32(21,7)8)23(39)26(41)37-34(16-17-34)25(40)27(42)35-20-12-13-20/h20-24H,9-19H2,1-8H3,(H,35,42)(H,37,41)(H2,36,38,44)/t21?,22?,23-,24-/m0/s1