1-[4-cyano-2-(phenylmethyl)pyrazol-3-yl]-3-(4-methylphenyl)sulfonyl-urea

Systemtic Name: 1-[4-cyano-2-(phenylmethyl)pyrazol-3-yl]-3-(4-methylphenyl)sulfonyl-urea Openeye Name: 1-(2-benzyl-4-cyano-pyrazol-3-yl)-3-(p-tolylsulfonyl)urea CAS Name: 1-[4-cyano-2-(phenylmethyl)-3-pyrazolyl]-3-(4-methylphenyl)sulfonylurea IUPAC Name: 1-(2-benzyl-4-cyanopyrazol-3-yl)-3-(4-methylphenyl)sulfonylurea Traditional Name: 1-(2-benzyl-4-cyano-pyrazol-3-yl)-3-tosyl-urea Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=C(C=NN2CC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=C(C=NN2CC3=CC=CC=C3)C#N

InChI

InChI=1S/C19H17N5O3S/c1-14-7-9-17(10-8-14)28(26,27)23-19(25)22-18-16(11-20)12-21-24(18)13-15-5-3-2-4-6-15/h2-10,12H,13H2,1H3,(H2,22,23,25)