N-(5-aminocarbonyl-2-pyrrolidin-1-yl-phenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(5-aminocarbonyl-2-pyrrolidin-1-yl-phenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-(5-carbamoyl-2-pyrrolidin-1-yl-phenyl)triazole-4-carboxamide CAS Name: N-[5-carbamoyl-2-(1-pyrrolidinyl)phenyl]-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(5-carbamoyl-2-pyrrolidin-1-ylphenyl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-(5-carbamoyl-2-pyrrolidino-phenyl)triazole-4-carboxamide Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N6O2/c22-20(28)16-8-9-19(26-10-4-5-11-26)17(12-16)23-21(29)18-14-27(25-24-18)13-15-6-2-1-3-7-15/h1-3,6-9,12,14H,4-5,10-11,13H2,(H2,22,28)(H,23,29)