N-(1,3-benzothiazol-2-yl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-keto-8-(trifluoromethyl)-1H-quinoline-3-carboxamide Formula: C18H10F3N3O2S MolecularWeight: 389.35111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CNC4=C(C3=O)C=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CNC4=C(C3=O)C=CC=C4C(F)(F)F

InChI

InChI=1S/C18H10F3N3O2S/c19-18(20,21)11-5-3-4-9-14(11)22-8-10(15(9)25)16(26)24-17-23-12-6-1-2-7-13(12)27-17/h1-8H,(H,22,25)(H,23,24,26)