1-(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)-3-(4-propan-2-ylphenyl)sulfonyl-urea

Systemtic Name: 1-(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)-3-(4-propan-2-ylphenyl)sulfonyl-urea Openeye Name: 1-(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)-3-(4-isopropylphenyl)sulfonyl-urea CAS Name: 1-(4-cyano-5-methyl-2-phenyl-3-pyrazolyl)-3-(4-propan-2-ylphenyl)sulfonylurea IUPAC Name: 1-(4-cyano-5-methyl-2-phenylpyrazol-3-yl)-3-(4-propan-2-ylphenyl)sulfonylurea Traditional Name: 1-(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)-3-p-cumenylsulfonyl-urea Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)C(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)C(C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H21N5O3S/c1-14(2)16-9-11-18(12-10-16)30(28,29)25-21(27)23-20-19(13-22)15(3)24-26(20)17-7-5-4-6-8-17/h4-12,14H,1-3H3,(H2,23,25,27)