4-(benzotriazol-1-ylmethyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]benzamide Formula: C27H29N5O MolecularWeight: 439.55206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=N2)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC(C)(CNC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=N2)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H29N5O/c1-27(2,31-16-15-21-7-3-4-8-23(21)18-31)19-28-26(33)22-13-11-20(12-14-22)17-32-25-10-6-5-9-24(25)29-30-32/h3-14H,15-19H2,1-2H3,(H,28,33)