4-[2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]ethyl]-N-ethyl-piperazine-1-carbothioamide

Systemtic Name: 4-[2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]ethyl]-N-ethyl-piperazine-1-carbothioamide Openeye Name: 4-[2-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]ethyl]-N-ethyl-piperazine-1-carbothioamide CAS Name: 4-[2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]ethyl]-N-ethyl-1-piperazinecarbothioamide IUPAC Name: 4-[2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]ethyl]-N-ethylpiperazine-1-carbothioamide Traditional Name: N-ethyl-4-[2-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]ethyl]piperazine-1-carbothioamide Formula: C17H30N4OS MolecularWeight: 338.5113

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCN(CC1)CCNC2=CC(=O)CC(C2)(C)C

Isomeric SMILES

CCNC(=S)N1CCN(CC1)CCNC2=CC(=O)CC(C2)(C)C

InChI

InChI=1S/C17H30N4OS/c1-4-18-16(23)21-9-7-20(8-10-21)6-5-19-14-11-15(22)13-17(2,3)12-14/h11,19H,4-10,12-13H2,1-3H3,(H,18,23)