N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidino-ethyl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=NN(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CO5

Isomeric SMILES

C1CCN(C1)[C@@H](CNC(=O)C2=NN(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CO5

InChI

InChI=1S/C25H25N5O2/c31-25(26-18-21(22-14-9-17-32-22)29-15-7-8-16-29)23-27-24(19-10-3-1-4-11-19)30(28-23)20-12-5-2-6-13-20/h1-6,9-14,17,21H,7-8,15-16,18H2,(H,26,31)/t21-/m0/s1