tert-butyl N-[(2S,3S)-4-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S)-4-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S)-1-benzyl-3-[[(1S)-1-carbamoyl-3-methyl-butyl]amino]-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3S)-4-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S)-4-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2S)-1-benzyl-3-[[(1S)-1-carbamoyl-3-methyl-butyl]amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C21H35N3O4 MolecularWeight: 393.5203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NCC(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)C[C@@H](C(=O)N)NC[C@@H]([C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C21H35N3O4/c1-14(2)11-17(19(22)26)23-13-18(25)16(12-15-9-7-6-8-10-15)24-20(27)28-21(3,4)5/h6-10,14,16-18,23,25H,11-13H2,1-5H3,(H2,22,26)(H,24,27)/t16-,17-,18-/m0/s1