N-[2-(1H-imidazol-2-ylmethyl)phenyl]-4-methyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-[2-(1H-imidazol-2-ylmethyl)phenyl]-4-methyl-1,4-diazepane-1-carboxamide Openeye Name: N-[2-(1H-imidazol-2-ylmethyl)phenyl]-4-methyl-1,4-diazepane-1-carboxamide CAS Name: N-[2-(1H-imidazol-2-ylmethyl)phenyl]-4-methyl-1,4-diazepane-1-carboxamide IUPAC Name: N-[2-(1H-imidazol-2-ylmethyl)phenyl]-4-methyl-1,4-diazepane-1-carboxamide Traditional Name: N-[2-(1H-imidazol-2-ylmethyl)phenyl]-4-methyl-1,4-diazepane-1-carboxamide Formula: C17H23N5O MolecularWeight: 313.39742

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)NC2=CC=CC=C2CC3=NC=CN3

Isomeric SMILES

CN1CCCN(CC1)C(=O)NC2=CC=CC=C2CC3=NC=CN3

InChI

InChI=1S/C17H23N5O/c1-21-9-4-10-22(12-11-21)17(23)20-15-6-3-2-5-14(15)13-16-18-7-8-19-16/h2-3,5-8H,4,9-13H2,1H3,(H,18,19)(H,20,23)