1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(3-piperidin-1-ylprop-1-ynyl)naphthalen-1-yl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(3-piperidin-1-ylprop-1-ynyl)naphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[3-(1-piperidyl)prop-1-ynyl]-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[4-[3-(1-piperidinyl)prop-1-ynyl]-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(3-piperidin-1-ylprop-1-ynyl)naphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-(3-piperidinoprop-1-ynyl)-1-naphthyl]urea Formula: C33H37N5O MolecularWeight: 519.67978

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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#CCN5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)C#CCN5CCCCC5

InChI

InChI=1S/C33H37N5O/c1-24-14-17-26(18-15-24)38-31(23-30(36-38)33(2,3)4)35-32(39)34-29-19-16-25(27-12-6-7-13-28(27)29)11-10-22-37-20-8-5-9-21-37/h6-7,12-19,23H,5,8-9,20-22H2,1-4H3,(H2,34,35,39)