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

Systemtic Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[4-(pyrrolidinomethyl)benzyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C22H25N5O/c28-22(21-9-7-20(8-10-21)15-27-17-23-16-25-27)24-13-18-3-5-19(6-4-18)14-26-11-1-2-12-26/h3-10,16-17H,1-2,11-15H2,(H,24,28)