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

Systemtic Name: 4-[2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]ethyl]-N-prop-2-enyl-piperazine-1-carbothioamide Openeye Name: N-allyl-4-[2-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]ethyl]piperazine-1-carbothioamide CAS Name: 4-[2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]ethyl]-N-prop-2-enyl-1-piperazinecarbothioamide IUPAC Name: 4-[2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]ethyl]-N-prop-2-enylpiperazine-1-carbothioamide Traditional Name: N-allyl-4-[2-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]ethyl]piperazine-1-carbothioamide Formula: C18H30N4OS MolecularWeight: 350.522

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NCCN2CCN(CC2)C(=S)NCC=C)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NCCN2CCN(CC2)C(=S)NCC=C)C

InChI

InChI=1S/C18H30N4OS/c1-4-5-20-17(24)22-10-8-21(9-11-22)7-6-19-15-12-16(23)14-18(2,3)13-15/h4,12,19H,1,5-11,13-14H2,2-3H3,(H,20,24)