1-(2-azanyl-3-phenyl-propanoyl)-2-(phenylmethyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: 1-(2-azanyl-3-phenyl-propanoyl)-2-(phenylmethyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: 1-(2-amino-3-phenyl-propanoyl)-2-benzylsulfonyl-pyrrolidine-2-carboxamide CAS Name: 1-(2-amino-1-oxo-3-phenylpropyl)-2-(phenylmethyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: 1-(2-amino-3-phenylpropanoyl)-2-benzylsulfonylpyrrolidine-2-carboxamide Traditional Name: 2-benzylsulfonyl-1-phenylalanyl-pyrrolidine-2-carboxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)(C(=O)N)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)(C(=O)N)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O4S/c22-18(14-16-8-3-1-4-9-16)19(25)24-13-7-12-21(24,20(23)26)29(27,28)15-17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15,22H2,(H2,23,26)