1-[5-tert-butyl-2-(6-methylpyridin-3-yl)pyrazol-3-yl]-3-[4-(2-methylsulfonylphenyl)naphthalen-1-yl]urea

Systemtic Name: 1-[5-tert-butyl-2-(6-methylpyridin-3-yl)pyrazol-3-yl]-3-[4-(2-methylsulfonylphenyl)naphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-2-(6-methyl-3-pyridyl)pyrazol-3-yl]-3-[4-(2-methylsulfonylphenyl)-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-2-(6-methyl-3-pyridinyl)-3-pyrazolyl]-3-[4-(2-methylsulfonylphenyl)-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(6-methylpyridin-3-yl)pyrazol-3-yl]-3-[4-(2-methylsulfonylphenyl)naphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-2-(6-methyl-3-pyridyl)pyrazol-3-yl]-3-[4-(2-mesylphenyl)-1-naphthyl]urea Formula: C31H31N5O3S MolecularWeight: 553.67454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)C5=CC=CC=C5S(=O)(=O)C

Isomeric SMILES

CC1=NC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)C5=CC=CC=C5S(=O)(=O)C

InChI

InChI=1S/C31H31N5O3S/c1-20-14-15-21(19-32-20)36-29(18-28(35-36)31(2,3)4)34-30(37)33-26-17-16-23(22-10-6-7-11-24(22)26)25-12-8-9-13-27(25)40(5,38)39/h6-19H,1-5H3,(H2,33,34,37)