1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]thiourea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]thiourea Openeye Name: [5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]thiourea CAS Name: [5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]thiourea IUPAC Name: [5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]thiourea Traditional Name: [5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]thiourea Formula: C15H20N4S MolecularWeight: 288.4111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=S)N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=S)N

InChI

InChI=1S/C15H20N4S/c1-10-5-7-11(8-6-10)19-13(17-14(16)20)9-12(18-19)15(2,3)4/h5-9H,1-4H3,(H3,16,17,20)