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

Systemtic Name: 1-[5-tert-butyl-2-(2-methylpyrimidin-5-yl)pyrazol-3-yl]-3-[4-(6-thiomorpholin-4-ylcarbonylpyridin-3-yl)naphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-2-(2-methylpyrimidin-5-yl)pyrazol-3-yl]-3-[4-[6-(thiomorpholine-4-carbonyl)-3-pyridyl]-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-2-(2-methyl-5-pyrimidinyl)-3-pyrazolyl]-3-[4-[6-[oxo(thiomorpholin-4-yl)methyl]-3-pyridinyl]-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(2-methylpyrimidin-5-yl)pyrazol-3-yl]-3-[4-[6-(thiomorpholine-4-carbonyl)pyridin-3-yl]naphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-2-(2-methylpyrimidin-5-yl)pyrazol-3-yl]-3-[4-[6-(thiomorpholine-4-carbonyl)-3-pyridyl]-1-naphthyl]urea Formula: C33H34N8O2S MolecularWeight: 606.74046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)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=NC=C(C=N1)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/C33H34N8O2S/c1-21-34-19-23(20-35-21)41-30(17-29(39-41)33(2,3)4)38-32(43)37-27-12-10-24(25-7-5-6-8-26(25)27)22-9-11-28(36-18-22)31(42)40-13-15-44-16-14-40/h5-12,17-20H,13-16H2,1-4H3,(H2,37,38,43)