1-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[3-[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-methoxyphenyl)thiourea Formula: C18H21F3N4OS MolecularWeight: 398.44575

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C(F)(F)F)C3CC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C(F)(F)F)C3CC3

InChI

InChI=1S/C18H21F3N4OS/c1-26-14-7-5-13(6-8-14)23-17(27)22-9-2-10-25-15(12-3-4-12)11-16(24-25)18(19,20)21/h5-8,11-12H,2-4,9-10H2,1H3,(H2,22,23,27)