1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[4-methyl-2-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[4-methyl-2-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(4-methyl-2-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-(4-methyl-2-piperidinosulfonyl-phenyl)thiourea Formula: C24H29N5O3S2 MolecularWeight: 499.64876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H29N5O3S2/c1-17-12-13-20(21(16-17)34(31,32)28-14-8-5-9-15-28)25-24(33)26-22-18(2)27(3)29(23(22)30)19-10-6-4-7-11-19/h4,6-7,10-13,16H,5,8-9,14-15H2,1-3H3,(H2,25,26,33)