1-(4-chlorophenyl)sulfonyl-3-[4-cyano-5-(2-dimethylaminoethyl)-2-phenyl-pyrazol-3-yl]urea

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-3-[4-cyano-5-(2-dimethylaminoethyl)-2-phenyl-pyrazol-3-yl]urea Openeye Name: 1-(4-chlorophenyl)sulfonyl-3-[4-cyano-5-(2-dimethylaminoethyl)-2-phenyl-pyrazol-3-yl]urea CAS Name: 1-(4-chlorophenyl)sulfonyl-3-[4-cyano-5-(2-dimethylaminoethyl)-2-phenyl-3-pyrazolyl]urea IUPAC Name: 1-(4-chlorophenyl)sulfonyl-3-[4-cyano-5-(2-dimethylaminoethyl)-2-phenylpyrazol-3-yl]urea Traditional Name: 1-(4-chlorophenyl)sulfonyl-3-[4-cyano-5-(2-dimethylaminoethyl)-2-phenyl-pyrazol-3-yl]urea Formula: C21H21ClN6O3S MolecularWeight: 472.94784

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=NN(C(=C1C#N)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCC1=NN(C(=C1C#N)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H21ClN6O3S/c1-27(2)13-12-19-18(14-23)20(28(25-19)16-6-4-3-5-7-16)24-21(29)26-32(30,31)17-10-8-15(22)9-11-17/h3-11H,12-13H2,1-2H3,(H2,24,26,29)