(1S,4S,5R)-N-[4-azanyl-1-cyclopropyl-3,4-bis(oxidanylidene)butan-2-yl]-3-[(2S)-2-[[(2R)-1-methoxy-2,4-dimethyl-pentan-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-cyclopropyl-3,4-bis(oxidanylidene)butan-2-yl]-3-[(2S)-2-[[(2R)-1-methoxy-2,4-dimethyl-pentan-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-(cyclopropylmethyl)-2,3-dioxo-propyl]-3-[(2S)-2-[[(1R)-1-(methoxymethyl)-1,3-dimethyl-butyl]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-cyclopropyl-3,4-dioxobutan-2-yl)-3-[(2S)-2-[[[[(2R)-1-methoxy-2,4-dimethylpentan-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-cyclopropyl-3,4-dioxobutan-2-yl)-3-[(2S)-2-[[(2R)-1-methoxy-2,4-dimethylpentan-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-(cyclopropylmethyl)-2,3-diketo-propyl]-3-[(2S)-2-[[(1R)-1-(methoxymethyl)-1,3-dimethyl-butyl]carbamoylamino]-2-(1-methylcyclohexyl)acetyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-4-carboxamide Formula: C33H55N5O6 MolecularWeight: 617.8197

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)(COC)NC(=O)NC(C(=O)N1CC2C(C1C(=O)NC(CC3CC3)C(=O)C(=O)N)C2(C)C)C4(CCCCC4)C

Isomeric SMILES

CC(C)C[C@](C)(COC)NC(=O)N[C@H](C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)NC(CC3CC3)C(=O)C(=O)N)C2(C)C)C4(CCCCC4)C

InChI

InChI=1S/C33H55N5O6/c1-19(2)16-33(6,18-44-7)37-30(43)36-26(32(5)13-9-8-10-14-32)29(42)38-17-21-23(31(21,3)4)24(38)28(41)35-22(15-20-11-12-20)25(39)27(34)40/h19-24,26H,8-18H2,1-7H3,(H2,34,40)(H,35,41)(H2,36,37,43)/t21-,22?,23-,24-,26+,33+/m0/s1