N-(2-methylpropyl)-4-(2-thiophen-2-ylethanoyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(2-methylpropyl)-4-(2-thiophen-2-ylethanoyl)-1,4-diazepane-1-carboxamide Openeye Name: N-isobutyl-4-[2-(2-thienyl)acetyl]-1,4-diazepane-1-carboxamide CAS Name: N-(2-methylpropyl)-4-(1-oxo-2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-(2-methylpropyl)-4-(2-thiophen-2-ylacetyl)-1,4-diazepane-1-carboxamide Traditional Name: N-isobutyl-4-[2-(2-thienyl)acetyl]-1,4-diazepane-1-carboxamide Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)N1CCCN(CC1)C(=O)CC2=CC=CS2

Isomeric SMILES

CC(C)CNC(=O)N1CCCN(CC1)C(=O)CC2=CC=CS2

InChI

InChI=1S/C16H25N3O2S/c1-13(2)12-17-16(21)19-7-4-6-18(8-9-19)15(20)11-14-5-3-10-22-14/h3,5,10,13H,4,6-9,11-12H2,1-2H3,(H,17,21)