N-[1-(benzotriazol-1-yl)-2,2-dimethyl-3-pyridin-4-yl-propyl]-3-methyl-benzamide

Systemtic Name: N-[1-(benzotriazol-1-yl)-2,2-dimethyl-3-pyridin-4-yl-propyl]-3-methyl-benzamide Openeye Name: N-[1-(benzotriazol-1-yl)-2,2-dimethyl-3-(4-pyridyl)propyl]-3-methyl-benzamide CAS Name: N-[1-(1-benzotriazolyl)-2,2-dimethyl-3-pyridin-4-ylpropyl]-3-methylbenzamide IUPAC Name: N-[1-(benzotriazol-1-yl)-2,2-dimethyl-3-pyridin-4-ylpropyl]-3-methylbenzamide Traditional Name: N-[1-(benzotriazol-1-yl)-2,2-dimethyl-3-(4-pyridyl)propyl]-3-methyl-benzamide Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)(C)CC2=CC=NC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C(C)(C)CC2=CC=NC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C24H25N5O/c1-17-7-6-8-19(15-17)22(30)26-23(24(2,3)16-18-11-13-25-14-12-18)29-21-10-5-4-9-20(21)27-28-29/h4-15,23H,16H2,1-3H3,(H,26,30)