1-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylpyrrol-2-yl)carbothioyl-urea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylpyrrol-2-yl)carbothioyl-urea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylpyrrole-2-carbothioyl)urea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[(1-methyl-2-pyrrolyl)-sulfanylidenemethyl]urea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylpyrrole-2-carbothioyl)urea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylpyrrole-2-carbothioyl)urea Formula: C15H11F6N3OS MolecularWeight: 395.322759

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=S)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C=CC=C1C(=S)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H11F6N3OS/c1-24-4-2-3-11(24)12(26)23-13(25)22-10-6-8(14(16,17)18)5-9(7-10)15(19,20)21/h2-7H,1H3,(H2,22,23,25,26)