1-[1-[4-(4-chlorophenyl)-3-(2-methylsulfonylphenyl)pyrazol-1-yl]prop-2-ynyl]-1-oxidanyl-urea

Systemtic Name: 1-[1-[4-(4-chlorophenyl)-3-(2-methylsulfonylphenyl)pyrazol-1-yl]prop-2-ynyl]-1-oxidanyl-urea Openeye Name: 1-[1-[4-(4-chlorophenyl)-3-(2-methylsulfonylphenyl)pyrazol-1-yl]prop-2-ynyl]-1-hydroxy-urea CAS Name: 1-[1-[4-(4-chlorophenyl)-3-(2-methylsulfonylphenyl)-1-pyrazolyl]prop-2-ynyl]-1-hydroxyurea IUPAC Name: 1-[1-[4-(4-chlorophenyl)-3-(2-methylsulfonylphenyl)pyrazol-1-yl]prop-2-ynyl]-1-hydroxyurea Traditional Name: 1-[1-[4-(4-chlorophenyl)-3-(2-mesylphenyl)pyrazol-1-yl]prop-2-ynyl]-1-hydroxy-urea Formula: C20H17ClN4O4S MolecularWeight: 444.89138

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=NN(C=C2C3=CC=C(C=C3)Cl)C(C#C)N(C(=O)N)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=NN(C=C2C3=CC=C(C=C3)Cl)C(C#C)N(C(=O)N)O

InChI

InChI=1S/C20H17ClN4O4S/c1-3-18(25(27)20(22)26)24-12-16(13-8-10-14(21)11-9-13)19(23-24)15-6-4-5-7-17(15)30(2,28)29/h1,4-12,18,27H,2H3,(H2,22,26)