1-[(2-methyl-5-nitro-pyridin-3-yl)carbonylamino]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(2-methyl-5-nitro-pyridin-3-yl)carbonylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(2-methyl-5-nitro-pyridine-3-carbonyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[(2-methyl-5-nitro-3-pyridinyl)-oxomethyl]amino]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(2-methyl-5-nitropyridine-3-carbonyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(2-methyl-5-nitro-nicotinoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C15H12F3N5O3S MolecularWeight: 399.34769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C(=O)NNC(=S)NC2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1C(=O)NNC(=S)NC2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H12F3N5O3S/c1-8-10(6-9(7-19-8)23(25)26)13(24)21-22-14(27)20-12-5-3-2-4-11(12)15(16,17)18/h2-7H,1H3,(H,21,24)(H2,20,22,27)