1-[2-(3-tert-butylphenyl)-3,4-dihydropyrazol-5-yl]-3-methyl-thiourea

Systemtic Name: 1-[2-(3-tert-butylphenyl)-3,4-dihydropyrazol-5-yl]-3-methyl-thiourea Openeye Name: 1-[2-(3-tert-butylphenyl)-3,4-dihydropyrazol-5-yl]-3-methyl-thiourea CAS Name: 1-[2-(3-tert-butylphenyl)-3,4-dihydropyrazol-5-yl]-3-methylthiourea IUPAC Name: 1-[2-(3-tert-butylphenyl)-3,4-dihydropyrazol-5-yl]-3-methylthiourea Traditional Name: 1-[1-(3-tert-butylphenyl)-2-pyrazolin-3-yl]-3-methyl-thiourea Formula: C15H22N4S MolecularWeight: 290.42698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C1)N2CCC(=N2)NC(=S)NC

Isomeric SMILES

CC(C)(C)C1=CC(=CC=C1)N2CCC(=N2)NC(=S)NC

InChI

InChI=1S/C15H22N4S/c1-15(2,3)11-6-5-7-12(10-11)19-9-8-13(18-19)17-14(20)16-4/h5-7,10H,8-9H2,1-4H3,(H2,16,17,18,20)