N-[(1R,2S)-2-methylcyclohexyl]-3-oxidanylidene-piperazine-1-carbothioamide

Systemtic Name: N-[(1R,2S)-2-methylcyclohexyl]-3-oxidanylidene-piperazine-1-carbothioamide Openeye Name: N-[(1R,2S)-2-methylcyclohexyl]-3-oxo-piperazine-1-carbothioamide CAS Name: N-[(1R,2S)-2-methylcyclohexyl]-3-oxo-1-piperazinecarbothioamide IUPAC Name: N-[(1R,2S)-2-methylcyclohexyl]-3-oxopiperazine-1-carbothioamide Traditional Name: 3-keto-N-[(1R,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide Formula: C12H21N3OS MolecularWeight: 255.37964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)N2CCNC(=O)C2

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=S)N2CCNC(=O)C2

InChI

InChI=1S/C12H21N3OS/c1-9-4-2-3-5-10(9)14-12(17)15-7-6-13-11(16)8-15/h9-10H,2-8H2,1H3,(H,13,16)(H,14,17)/t9-,10+/m0/s1