1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(2,6-dimethylpiperidin-1-yl)thiourea

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(2,6-dimethylpiperidin-1-yl)thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(2,6-dimethyl-1-piperidyl)thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(2,6-dimethyl-1-piperidinyl)thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(2,6-dimethylpiperidin-1-yl)thiourea Traditional Name: 1-(2,6-dimethylpiperidino)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1NC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

Isomeric SMILES

CC1CCCC(N1NC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

InChI

InChI=1S/C19H27N5OS/c1-13-9-8-10-14(2)23(13)21-19(26)20-17-15(3)22(4)24(18(17)25)16-11-6-5-7-12-16/h5-7,11-14H,8-10H2,1-4H3,(H2,20,21,26)