N-(2,6-dimethylpiperidin-1-yl)-1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazole-4-carbothioamide

Systemtic Name: N-(2,6-dimethylpiperidin-1-yl)-1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazole-4-carbothioamide Openeye Name: N-(2,6-dimethyl-1-piperidyl)-1,5-dimethyl-3-oxo-2-phenyl-pyrazole-4-carbothioamide CAS Name: N-(2,6-dimethyl-1-piperidinyl)-1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolecarbothioamide IUPAC Name: N-(2,6-dimethylpiperidin-1-yl)-1,5-dimethyl-3-oxo-2-phenylpyrazole-4-carbothioamide Traditional Name: N-(2,6-dimethylpiperidino)-3-keto-1,5-dimethyl-2-phenyl-3-pyrazoline-4-carbothioamide Formula: C19H26N4OS MolecularWeight: 358.50094

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1NC(=S)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

Isomeric SMILES

CC1CCCC(N1NC(=S)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

InChI

InChI=1S/C19H26N4OS/c1-13-9-8-10-14(2)22(13)20-18(25)17-15(3)21(4)23(19(17)24)16-11-6-5-7-12-16/h5-7,11-14H,8-10H2,1-4H3,(H,20,25)