(phenylmethyl) N-[(2S)-1-[(3-aminocarbonyl-4-chloranyl-phenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(3-aminocarbonyl-4-chloranyl-phenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-benzyl-2-(3-carbamoyl-4-chloro-anilino)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-(3-carbamoyl-4-chloroanilino)-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(3-carbamoyl-4-chloroanilino)-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-(3-carbamoyl-4-chloro-anilino)-2-keto-ethyl]carbamic acid benzyl ester Formula: C24H22ClN3O4 MolecularWeight: 451.90218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC(=C(C=C2)Cl)C(=O)N)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=CC(=C(C=C2)Cl)C(=O)N)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H22ClN3O4/c25-20-12-11-18(14-19(20)22(26)29)27-23(30)21(13-16-7-3-1-4-8-16)28-24(31)32-15-17-9-5-2-6-10-17/h1-12,14,21H,13,15H2,(H2,26,29)(H,27,30)(H,28,31)/t21-/m0/s1