1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-[4-(4-hydroxyphenyl)sulfanylphenyl]urea

Systemtic Name: 1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-[4-(4-hydroxyphenyl)sulfanylphenyl]urea Openeye Name: 1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-[4-(4-hydroxyphenyl)sulfanylphenyl]urea CAS Name: 1-(5-tert-butyl-2-methyl-3-pyrazolyl)-3-[4-[(4-hydroxyphenyl)thio]phenyl]urea IUPAC Name: 1-(5-tert-butyl-2-methylpyrazol-3-yl)-3-[4-(4-hydroxyphenyl)sulfanylphenyl]urea Traditional Name: 1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-[4-[(4-hydroxyphenyl)thio]phenyl]urea Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)O)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)O)C

InChI

InChI=1S/C21H24N4O2S/c1-21(2,3)18-13-19(25(4)24-18)23-20(27)22-14-5-9-16(10-6-14)28-17-11-7-15(26)8-12-17/h5-13,26H,1-4H3,(H2,22,23,27)