N-[2-(dimethylamino)-3-phenyl-propyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[2-(dimethylamino)-3-phenyl-propyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[2-(dimethylamino)-3-phenyl-propyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[2-(dimethylamino)-3-phenylpropyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[2-(dimethylamino)-3-phenylpropyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[2-(dimethylamino)-3-phenyl-propyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CC1=CC=CC=C1)CNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CN(C)C(CC1=CC=CC=C1)CNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C21H25N5O/c1-25(2)20(12-17-6-4-3-5-7-17)13-23-21(27)19-10-8-18(9-11-19)14-26-16-22-15-24-26/h3-11,15-16,20H,12-14H2,1-2H3,(H,23,27)