4-azido-1-(4-methylphenyl)sulfonyl-N-[(2S)-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 4-azido-1-(4-methylphenyl)sulfonyl-N-[(2S)-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide Openeye Name: 4-azido-N-[(1S)-1-benzyl-2-oxo-ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: 4-azido-1-(4-methylphenyl)sulfonyl-N-[(2S)-1-oxo-3-phenylpropan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 4-azido-1-(4-methylphenyl)sulfonyl-N-[(2S)-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide Traditional Name: 4-azido-N-[(1S)-1-benzyl-2-keto-ethyl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C21H23N5O4S MolecularWeight: 441.50342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)NC(CC3=CC=CC=C3)C=O)N=[N+]=[N-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)N[C@@H](CC3=CC=CC=C3)C=O)N=[N+]=[N-]

InChI

InChI=1S/C21H23N5O4S/c1-15-7-9-19(10-8-15)31(29,30)26-13-17(24-25-22)12-20(26)21(28)23-18(14-27)11-16-5-3-2-4-6-16/h2-10,14,17-18,20H,11-13H2,1H3,(H,23,28)/t17?,18-,20?/m0/s1