(3S)-5-oxidanylidene-1-phenyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-5-oxidanylidene-1-phenyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-5-oxo-1-phenyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide CAS Name: (3S)-5-oxo-1-phenyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-5-oxo-1-phenyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-1-phenyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H19N5O2/c26-19-10-16(12-25(19)18-4-2-1-3-5-18)20(27)23-17-8-6-15(7-9-17)11-24-14-21-13-22-24/h1-9,13-14,16H,10-12H2,(H,23,27)/t16-/m0/s1