1-(4-bromophenyl)-3-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea

Systemtic Name: 1-(4-bromophenyl)-3-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea Openeye Name: 1-(4-bromophenyl)-3-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiourea CAS Name: 1-(4-bromophenyl)-3-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[1-[(4-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]thiourea Traditional Name: 1-(4-bromophenyl)-3-[1-(4-fluorobenzyl)-3,5-dimethyl-pyrazol-4-yl]thiourea Formula: C19H18BrFN4S MolecularWeight: 433.340423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)F)C)NC(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)F)C)NC(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrFN4S/c1-12-18(23-19(26)22-17-9-5-15(20)6-10-17)13(2)25(24-12)11-14-3-7-16(21)8-4-14/h3-10H,11H2,1-2H3,(H2,22,23,26)