N-cyclooctyl-4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide

Systemtic Name: N-cyclooctyl-4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide Openeye Name: N-cyclooctyl-4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide CAS Name: N-cyclooctyl-4-[(5-methyl-3-isoxazolyl)methyl]-1,4-diazepane-1-carbothioamide IUPAC Name: N-cyclooctyl-4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide Traditional Name: N-cyclooctyl-4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide Formula: C19H32N4OS MolecularWeight: 364.54858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCCN(CC2)C(=S)NC3CCCCCCC3

Isomeric SMILES

CC1=CC(=NO1)CN2CCCN(CC2)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C19H32N4OS/c1-16-14-18(21-24-16)15-22-10-7-11-23(13-12-22)19(25)20-17-8-5-3-2-4-6-9-17/h14,17H,2-13,15H2,1H3,(H,20,25)