1-(4-butan-2-ylphenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea Openeye Name: 1-(1H-pyrazol-5-ylmethyl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea Traditional Name: 1-(1H-pyrazol-5-ylmethyl)-3-(4-sec-butylphenyl)thiourea Formula: C15H20N4S MolecularWeight: 288.4111

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NCC2=CC=NN2

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NCC2=CC=NN2

InChI

InChI=1S/C15H20N4S/c1-3-11(2)12-4-6-13(7-5-12)18-15(20)16-10-14-8-9-17-19-14/h4-9,11H,3,10H2,1-2H3,(H,17,19)(H2,16,18,20)