N,N-diethyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]benzamide

Systemtic Name: N,N-diethyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]benzamide Openeye Name: N,N-diethyl-3-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]benzamide CAS Name: N,N-diethyl-3-[[oxo-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]amino]benzamide IUPAC Name: N,N-diethyl-3-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]benzamide Traditional Name: N,N-diethyl-3-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]benzamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C21H23N5O2/c1-3-25(4-2)21(28)18-6-5-7-19(12-18)24-20(27)17-10-8-16(9-11-17)13-26-15-22-14-23-26/h5-12,14-15H,3-4,13H2,1-2H3,(H,24,27)