4-(benzotriazol-1-ylmethyl)-N-[6-(dimethylamino)pyridin-3-yl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[6-(dimethylamino)pyridin-3-yl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[6-(dimethylamino)-3-pyridyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[6-(dimethylamino)-3-pyridinyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[6-(dimethylamino)pyridin-3-yl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[6-(dimethylamino)-3-pyridyl]benzamide Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CN(C)C1=NC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H20N6O/c1-26(2)20-12-11-17(13-22-20)23-21(28)16-9-7-15(8-10-16)14-27-19-6-4-3-5-18(19)24-25-27/h3-13H,14H2,1-2H3,(H,23,28)