N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(2-phenyl-2-pyrrolidin-1-ylethyl)-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(2-phenyl-2-pyrrolidino-ethyl)-4-(1,2,4-triazol-1-yl)benzamide Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC=C(C=C2)N3C=NC=N3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC=C(C=C2)N3C=NC=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5O/c27-21(18-8-10-19(11-9-18)26-16-22-15-24-26)23-14-20(25-12-4-5-13-25)17-6-2-1-3-7-17/h1-3,6-11,15-16,20H,4-5,12-14H2,(H,23,27)