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

Systemtic Name: 1-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[1-[(4-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[1-(4-fluorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-3-(4-methoxyphenyl)thiourea Formula: C20H21FN4OS MolecularWeight: 384.470343

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H21FN4OS/c1-13-19(23-20(27)22-17-8-10-18(26-3)11-9-17)14(2)25(24-13)12-15-4-6-16(21)7-5-15/h4-11H,12H2,1-3H3,(H2,22,23,27)