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

Systemtic Name: N-cyclooctyl-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide Openeye Name: N-cyclooctyl-4-[(3,5-dimethylisoxazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide CAS Name: N-cyclooctyl-4-[(3,5-dimethyl-4-isoxazolyl)methyl]-1,4-diazepane-1-carbothioamide IUPAC Name: N-cyclooctyl-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide Traditional Name: N-cyclooctyl-4-[(3,5-dimethylisoxazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide Formula: C20H34N4OS MolecularWeight: 378.57516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H34N4OS/c1-16-19(17(2)25-22-16)15-23-11-8-12-24(14-13-23)20(26)21-18-9-6-4-3-5-7-10-18/h18H,3-15H2,1-2H3,(H,21,26)