1-butyl-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-butyl-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-butyl-3-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-butyl-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-butyl-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-butyl-3-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]thiourea Formula: C18H26N4S MolecularWeight: 330.49084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=C(N(N=C1C)CC2=CC=CC=C2C)C

Isomeric SMILES

CCCCNC(=S)NC1=C(N(N=C1C)CC2=CC=CC=C2C)C

InChI

InChI=1S/C18H26N4S/c1-5-6-11-19-18(23)20-17-14(3)21-22(15(17)4)12-16-10-8-7-9-13(16)2/h7-10H,5-6,11-12H2,1-4H3,(H2,19,20,23)