[(3R)-4,4-dimethyl-1-(1H-1,2,4-triazol-5-ylcarbonyl)pyrrolidin-3-yl] N-[(3S)-1,2-bis(oxidanylidene)-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate

Systemtic Name: [(3R)-4,4-dimethyl-1-(1H-1,2,4-triazol-5-ylcarbonyl)pyrrolidin-3-yl] N-[(3S)-1,2-bis(oxidanylidene)-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate Openeye Name: [(3R)-4,4-dimethyl-1-(1H-1,2,4-triazole-5-carbonyl)pyrrolidin-3-yl] N-[(1S)-1-[2-oxo-2-[[(1R)-1-phenylethyl]amino]acetyl]pentyl]carbamate CAS Name: N-[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamic acid [(3R)-4,4-dimethyl-1-[oxo(1H-1,2,4-triazol-5-yl)methyl]-3-pyrrolidinyl] ester IUPAC Name: [(3R)-4,4-dimethyl-1-(1H-1,2,4-triazole-5-carbonyl)pyrrolidin-3-yl] N-[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate Traditional Name: N-[(1S)-1-[2-keto-2-[[(1R)-1-phenylethyl]amino]acetyl]pentyl]carbamic acid [(3R)-4,4-dimethyl-1-(1H-1,2,4-triazole-5-carbonyl)pyrrolidin-3-yl] ester Formula: C25H34N6O5 MolecularWeight: 498.57466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(=O)NC(C)C1=CC=CC=C1)NC(=O)OC2CN(CC2(C)C)C(=O)C3=NC=NN3

Isomeric SMILES

CCCC[C@@H](C(=O)C(=O)N[C@H](C)C1=CC=CC=C1)NC(=O)O[C@H]2CN(CC2(C)C)C(=O)C3=NC=NN3

InChI

InChI=1S/C25H34N6O5/c1-5-6-12-18(20(32)22(33)28-16(2)17-10-8-7-9-11-17)29-24(35)36-19-13-31(14-25(19,3)4)23(34)21-26-15-27-30-21/h7-11,15-16,18-19H,5-6,12-14H2,1-4H3,(H,28,33)(H,29,35)(H,26,27,30)/t16-,18+,19+/m1/s1