4-[(1-methylimidazol-2-yl)methyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[(1-methylimidazol-2-yl)methyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[(1-methylimidazol-2-yl)methyl]-N-[2-(2-thienyl)ethyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[(1-methyl-2-imidazolyl)methyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[(1-methylimidazol-2-yl)methyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[(1-methylimidazol-2-yl)methyl]-N-[2-(2-thienyl)ethyl]-1,4-diazepane-1-carboxamide Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN2CCCN(CC2)C(=O)NCCC3=CC=CS3

Isomeric SMILES

CN1C=CN=C1CN2CCCN(CC2)C(=O)NCCC3=CC=CS3

InChI

InChI=1S/C17H25N5OS/c1-20-10-7-18-16(20)14-21-8-3-9-22(12-11-21)17(23)19-6-5-15-4-2-13-24-15/h2,4,7,10,13H,3,5-6,8-9,11-12,14H2,1H3,(H,19,23)