4-ethanoyl-N-(2,4,4-trimethylpentan-2-yl)-1,4-diazepane-1-carbothioamide

Systemtic Name: 4-ethanoyl-N-(2,4,4-trimethylpentan-2-yl)-1,4-diazepane-1-carbothioamide Openeye Name: 4-acetyl-N-(1,1,3,3-tetramethylbutyl)-1,4-diazepane-1-carbothioamide CAS Name: 4-acetyl-N-(2,4,4-trimethylpentan-2-yl)-1,4-diazepane-1-carbothioamide IUPAC Name: 4-acetyl-N-(2,4,4-trimethylpentan-2-yl)-1,4-diazepane-1-carbothioamide Traditional Name: 4-acetyl-N-(1,1,3,3-tetramethylbutyl)-1,4-diazepane-1-carbothioamide Formula: C16H31N3OS MolecularWeight: 313.50184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)C(=S)NC(C)(C)CC(C)(C)C

Isomeric SMILES

CC(=O)N1CCCN(CC1)C(=S)NC(C)(C)CC(C)(C)C

InChI

InChI=1S/C16H31N3OS/c1-13(20)18-8-7-9-19(11-10-18)14(21)17-16(5,6)12-15(2,3)4/h7-12H2,1-6H3,(H,17,21)