tert-butyl N-[(2S,3S,5R)-6-[[(1S)-2-methyl-1-(1H-1,2,4-triazol-5-yl)propyl]amino]-3-oxidanyl-6-oxidanylidene-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S,5R)-6-[[(1S)-2-methyl-1-(1H-1,2,4-triazol-5-yl)propyl]amino]-3-oxidanyl-6-oxidanylidene-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S,4R)-1,4-dibenzyl-2-hydroxy-5-[[(1S)-2-methyl-1-(1H-1,2,4-triazol-5-yl)propyl]amino]-5-oxo-pentyl]carbamate CAS Name: N-[(2S,3S,5R)-3-hydroxy-6-[[(1S)-2-methyl-1-(1H-1,2,4-triazol-5-yl)propyl]amino]-6-oxo-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(1S)-2-methyl-1-(1H-1,2,4-triazol-5-yl)propyl]amino]-6-oxo-1-phenylhexan-2-yl]carbamate Traditional Name: N-[(1S,2S,4R)-1,4-dibenzyl-2-hydroxy-5-keto-5-[[(1S)-2-methyl-1-(1H-1,2,4-triazol-5-yl)propyl]amino]pentyl]carbamic acid tert-butyl ester Formula: C30H41N5O4 MolecularWeight: 535.67764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NC=NN1)NC(=O)C(CC2=CC=CC=C2)CC(C(CC3=CC=CC=C3)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)[C@@H](C1=NC=NN1)NC(=O)[C@H](CC2=CC=CC=C2)C[C@@H]([C@H](CC3=CC=CC=C3)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C30H41N5O4/c1-20(2)26(27-31-19-32-35-27)34-28(37)23(16-21-12-8-6-9-13-21)18-25(36)24(17-22-14-10-7-11-15-22)33-29(38)39-30(3,4)5/h6-15,19-20,23-26,36H,16-18H2,1-5H3,(H,33,38)(H,34,37)(H,31,32,35)/t23-,24+,25+,26+/m1/s1