1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(6-thiomorpholin-4-ylcarbonylpyridin-3-yl)naphthalen-1-yl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(6-thiomorpholin-4-ylcarbonylpyridin-3-yl)naphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[6-(thiomorpholine-4-carbonyl)-3-pyridyl]-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[4-[6-[oxo(thiomorpholin-4-yl)methyl]-3-pyridinyl]-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[6-(thiomorpholine-4-carbonyl)pyridin-3-yl]naphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[6-(thiomorpholine-4-carbonyl)-3-pyridyl]-1-naphthyl]urea Formula: C35H36N6O2S MolecularWeight: 604.76434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)C5=CN=C(C=C5)C(=O)N6CCSCC6

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)C5=CN=C(C=C5)C(=O)N6CCSCC6

InChI

InChI=1S/C35H36N6O2S/c1-23-9-12-25(13-10-23)41-32(21-31(39-41)35(2,3)4)38-34(43)37-29-16-14-26(27-7-5-6-8-28(27)29)24-11-15-30(36-22-24)33(42)40-17-19-44-20-18-40/h5-16,21-22H,17-20H2,1-4H3,(H2,37,38,43)