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

Systemtic Name: 1-(3,5-dimethoxyphenyl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-(3,5-dimethoxyphenyl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]thiourea CAS Name: 1-(3,5-dimethoxyphenyl)-3-[1-[(4-fluorophenyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-(3,5-dimethoxyphenyl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-(3,5-dimethoxyphenyl)-3-[1-(4-fluorobenzyl)pyrazol-4-yl]thiourea Formula: C19H19FN4O2S MolecularWeight: 386.443163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C19H19FN4O2S/c1-25-17-7-15(8-18(9-17)26-2)22-19(27)23-16-10-21-24(12-16)11-13-3-5-14(20)6-4-13/h3-10,12H,11H2,1-2H3,(H2,22,23,27)