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

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-1-(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)-1-propan-2-yl-urea Openeye Name: 3-(4-chlorophenyl)sulfonyl-1-(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)-1-isopropyl-urea CAS Name: 3-(4-chlorophenyl)sulfonyl-1-(4-cyano-5-methyl-2-phenyl-3-pyrazolyl)-1-propan-2-ylurea IUPAC Name: 3-(4-chlorophenyl)sulfonyl-1-(4-cyano-5-methyl-2-phenylpyrazol-3-yl)-1-propan-2-ylurea Traditional Name: 3-(4-chlorophenyl)sulfonyl-1-(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)-1-isopropyl-urea Formula: C21H20ClN5O3S MolecularWeight: 457.9332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN5O3S/c1-14(2)26(21(28)25-31(29,30)18-11-9-16(22)10-12-18)20-19(13-23)15(3)24-27(20)17-7-5-4-6-8-17/h4-12,14H,1-3H3,(H,25,28)