1-[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]-3-(3-fluoranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-[[2-(3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C15H18FN5OS MolecularWeight: 335.399723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)CN2C(=CC(=N2)C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)CN2C(=CC(=N2)C)C)F

InChI

InChI=1S/C15H18FN5OS/c1-9-4-5-12(7-13(9)16)17-15(23)19-18-14(22)8-21-11(3)6-10(2)20-21/h4-7H,8H2,1-3H3,(H,18,22)(H2,17,19,23)