N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-2H-benzotriazole-5-carboxamide Openeye Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-2H-benzotriazole-5-carboxamide CAS Name: N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-2H-benzotriazole-5-carboxamide Traditional Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-2H-benzotriazole-5-carboxamide Formula: C20H24N6O MolecularWeight: 364.44416

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC(C1)NC(=O)C2=CC3=NNN=C3C=C2)CC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC(C1)NC(=O)C2=CC3=NNN=C3C=C2)CC4=CC=CC=C4

InChI

InChI=1S/C20H24N6O/c1-25-9-10-26(12-15-5-3-2-4-6-15)14-17(13-25)21-20(27)16-7-8-18-19(11-16)23-24-22-18/h2-8,11,17H,9-10,12-14H2,1H3,(H,21,27)(H,22,23,24)