[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl] 2,6-dimethylpiperidine-1-carbodithioate

Systemtic Name: [2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl] 2,6-dimethylpiperidine-1-carbodithioate Openeye Name: [2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl] 2,6-dimethylpiperidine-1-carbodithioate CAS Name: 2,6-dimethyl-1-piperidinecarbodithioic acid [2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl] 2,6-dimethylpiperidine-1-carbodithioate Traditional Name: 2,6-dimethylpiperidine-1-carbodithioic acid [2-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]ethyl] ester Formula: C21H28N4O2S2 MolecularWeight: 432.60262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=S)SCC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

Isomeric SMILES

CC1CCCC(N1C(=S)SCC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

InChI

InChI=1S/C21H28N4O2S2/c1-14-9-8-10-15(2)24(14)21(28)29-13-18(26)22-19-16(3)23(4)25(20(19)27)17-11-6-5-7-12-17/h5-7,11-12,14-15H,8-10,13H2,1-4H3,(H,22,26)