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

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-fluorophenyl)-1-methyl-thiourea Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-fluorophenyl)-1-methyl-thiourea CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-(2-fluorophenyl)-1-methylthiourea IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-(2-fluorophenyl)-1-methylthiourea Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-fluorophenyl)-1-methyl-thiourea Formula: C20H21FN4S MolecularWeight: 368.470943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=S)NC3=CC=CC=C3F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C20H21FN4S/c1-14-17(15(2)25(23-14)16-9-5-4-6-10-16)13-24(3)20(26)22-19-12-8-7-11-18(19)21/h4-12H,13H2,1-3H3,(H,22,26)