N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[4-(pyrrolidinomethyl)benzyl]-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)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C21H23N5O/c27-21(19-7-9-20(10-8-19)26-16-22-15-24-26)23-13-17-3-5-18(6-4-17)14-25-11-1-2-12-25/h3-10,15-16H,1-2,11-14H2,(H,23,27)