(phenylmethyl) N-[(2S)-1-oxidanylidene-3-phenyl-1-[[(3S)-1-phenyl-5-sulfanyl-pentan-3-yl]amino]propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-oxidanylidene-3-phenyl-1-[[(3S)-1-phenyl-5-sulfanyl-pentan-3-yl]amino]propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-benzyl-2-oxo-2-[[(1S)-1-phenethyl-3-sulfanyl-propyl]amino]ethyl]carbamate CAS Name: N-[(2S)-1-[[(3S)-1-mercapto-5-phenylpentan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-oxo-3-phenyl-1-[[(3S)-1-phenyl-5-sulfanylpentan-3-yl]amino]propan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[[(1S)-1-(2-mercaptoethyl)-3-phenyl-propyl]amino]ethyl]carbamic acid benzyl ester Formula: C28H32N2O3S MolecularWeight: 476.63028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(CCS)NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C28H32N2O3S/c31-27(29-25(18-19-34)17-16-22-10-4-1-5-11-22)26(20-23-12-6-2-7-13-23)30-28(32)33-21-24-14-8-3-9-15-24/h1-15,25-26,34H,16-21H2,(H,29,31)(H,30,32)/t25-,26-/m0/s1