1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(3-methyl-3-morpholin-4-yl-but-1-ynyl)naphthalen-1-yl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(3-methyl-3-morpholin-4-yl-but-1-ynyl)naphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-(3-methyl-3-morpholino-but-1-ynyl)-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[4-[3-methyl-3-(4-morpholinyl)but-1-ynyl]-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(3-methyl-3-morpholin-4-ylbut-1-ynyl)naphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-(3-methyl-3-morpholino-but-1-ynyl)-1-naphthyl]urea Formula: C34H39N5O2 MolecularWeight: 549.70576

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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)C#CC(C)(C)N5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)C#CC(C)(C)N5CCOCC5

InChI

InChI=1S/C34H39N5O2/c1-24-11-14-26(15-12-24)39-31(23-30(37-39)33(2,3)4)36-32(40)35-29-16-13-25(27-9-7-8-10-28(27)29)17-18-34(5,6)38-19-21-41-22-20-38/h7-16,23H,19-22H2,1-6H3,(H2,35,36,40)