1-methyl-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea

Systemtic Name: 1-methyl-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-methyl-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea CAS Name: 1-methyl-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-methyl-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]-3-methyl-thiourea Formula: C12H10F3N3OS MolecularWeight: 301.28751

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC2=C(C=C1)NC(=O)C=C2C(F)(F)F

Isomeric SMILES

CNC(=S)NC1=CC2=C(C=C1)NC(=O)C=C2C(F)(F)F

InChI

InChI=1S/C12H10F3N3OS/c1-16-11(20)17-6-2-3-9-7(4-6)8(12(13,14)15)5-10(19)18-9/h2-5H,1H3,(H,18,19)(H2,16,17,20)