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

Systemtic Name: N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]quinoline-2-carboxamide Openeye Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)quinoline-2-carboxamide CAS Name: N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-2-quinolinecarboxamide IUPAC Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)quinoline-2-carboxamide Traditional Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)quinaldamide Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC(C1)NC(=O)C2=NC3=CC=CC=C3C=C2)CC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC(C1)NC(=O)C2=NC3=CC=CC=C3C=C2)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O/c1-26-13-14-27(15-18-7-3-2-4-8-18)17-20(16-26)24-23(28)22-12-11-19-9-5-6-10-21(19)25-22/h2-12,20H,13-17H2,1H3,(H,24,28)