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

Systemtic Name: 1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-[4-(4-propoxyphenyl)sulfanylphenyl]urea Openeye Name: 1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-[4-(4-propoxyphenyl)sulfanylphenyl]urea CAS Name: 1-(5-tert-butyl-2-methyl-3-pyrazolyl)-3-[4-[(4-propoxyphenyl)thio]phenyl]urea IUPAC Name: 1-(5-tert-butyl-2-methylpyrazol-3-yl)-3-[4-(4-propoxyphenyl)sulfanylphenyl]urea Traditional Name: 1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-[4-[(4-propoxyphenyl)thio]phenyl]urea Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)SC2=CC=C(C=C2)NC(=O)NC3=CC(=NN3C)C(C)(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)SC2=CC=C(C=C2)NC(=O)NC3=CC(=NN3C)C(C)(C)C

InChI

InChI=1S/C24H30N4O2S/c1-6-15-30-18-9-13-20(14-10-18)31-19-11-7-17(8-12-19)25-23(29)26-22-16-21(24(2,3)4)27-28(22)5/h7-14,16H,6,15H2,1-5H3,(H2,25,26,29)