pyridin-3-ylmethyl N-[(2S)-1-[[(3S)-1-tert-butylsulfanyl-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: pyridin-3-ylmethyl N-[(2S)-1-[[(3S)-1-tert-butylsulfanyl-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: 3-pyridylmethyl N-[(1S)-1-benzyl-2-[[(1S)-3-tert-butylsulfanyl-2-oxo-1-phenethyl-propyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[[(3S)-1-(tert-butylthio)-2-oxo-5-phenylpentan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[(2S)-1-[[(3S)-1-tert-butylsulfanyl-2-oxo-5-phenylpentan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-[[(1S)-3-(tert-butylthio)-2-keto-1-phenethyl-propyl]amino]-2-keto-ethyl]carbamic acid 3-pyridylmethyl ester Formula: C31H37N3O4S MolecularWeight: 547.70818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)C(CCC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)SCC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CN=CC=C3

InChI

InChI=1S/C31H37N3O4S/c1-31(2,3)39-22-28(35)26(17-16-23-11-6-4-7-12-23)33-29(36)27(19-24-13-8-5-9-14-24)34-30(37)38-21-25-15-10-18-32-20-25/h4-15,18,20,26-27H,16-17,19,21-22H2,1-3H3,(H,33,36)(H,34,37)/t26-,27-/m0/s1