1-(4-butan-2-ylphenyl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)thiourea Openeye Name: 1-(1-ethyl-3-methyl-pyrazol-4-yl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(1-ethyl-3-methyl-4-pyrazolyl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(1-ethyl-3-methylpyrazol-4-yl)thiourea Traditional Name: 1-(1-ethyl-3-methyl-pyrazol-4-yl)-3-(4-sec-butylphenyl)thiourea Formula: C17H24N4S MolecularWeight: 316.46426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NC2=CN(N=C2C)CC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NC2=CN(N=C2C)CC

InChI

InChI=1S/C17H24N4S/c1-5-12(3)14-7-9-15(10-8-14)18-17(22)19-16-11-21(6-2)20-13(16)4/h7-12H,5-6H2,1-4H3,(H2,18,19,22)