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

Systemtic Name: 1-(4-cyano-2-phenyl-5-propan-2-yl-pyrazol-3-yl)-3-(4-methylphenyl)sulfonyl-urea Openeye Name: 1-(4-cyano-5-isopropyl-2-phenyl-pyrazol-3-yl)-3-(p-tolylsulfonyl)urea CAS Name: 1-(4-cyano-2-phenyl-5-propan-2-yl-3-pyrazolyl)-3-(4-methylphenyl)sulfonylurea IUPAC Name: 1-(4-cyano-2-phenyl-5-propan-2-ylpyrazol-3-yl)-3-(4-methylphenyl)sulfonylurea Traditional Name: 1-(4-cyano-5-isopropyl-2-phenyl-pyrazol-3-yl)-3-tosyl-urea Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=C(C(=NN2C3=CC=CC=C3)C(C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=C(C(=NN2C3=CC=CC=C3)C(C)C)C#N

InChI

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