methyl 4-[[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-(4-chlorophenyl)sulfonyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-(4-chlorophenyl)sulfonyl-amino]methyl]benzoate Openeye Name: methyl 4-[[(2-amino-1-benzyl-2-oxo-ethyl)-(4-chlorophenyl)sulfonyl-amino]methyl]benzoate CAS Name: 4-[[(1-amino-1-oxo-3-phenylpropan-2-yl)-(4-chlorophenyl)sulfonylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1-amino-1-oxo-3-phenylpropan-2-yl)-(4-chlorophenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[[(2-amino-1-benzyl-2-keto-ethyl)-(4-chlorophenyl)sulfonyl-amino]methyl]benzoic acid methyl ester Formula: C24H23ClN2O5S MolecularWeight: 486.96782

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(C(CC2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(C(CC2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H23ClN2O5S/c1-32-24(29)19-9-7-18(8-10-19)16-27(33(30,31)21-13-11-20(25)12-14-21)22(23(26)28)15-17-5-3-2-4-6-17/h2-14,22H,15-16H2,1H3,(H2,26,28)