6-[(Z)-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-4-[2,2,2-tris(fluoranyl)ethoxy]quinoline-3-carbonitrile

Systemtic Name: 6-[(Z)-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-4-[2,2,2-tris(fluoranyl)ethoxy]quinoline-3-carbonitrile Openeye Name: 6-[(Z)-(2-amino-4-oxo-thiazol-5-ylidene)methyl]-4-(2,2,2-trifluoroethoxy)quinoline-3-carbonitrile CAS Name: 6-[(Z)-(2-amino-4-oxo-5-thiazolylidene)methyl]-4-(2,2,2-trifluoroethoxy)-3-quinolinecarbonitrile IUPAC Name: 6-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-4-(2,2,2-trifluoroethoxy)quinoline-3-carbonitrile Traditional Name: 6-[(Z)-(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-4-(2,2,2-trifluoroethoxy)quinoline-3-carbonitrile Formula: C16H9F3N4O2S MolecularWeight: 378.32847

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=C(C(=C2C=C1C=C3C(=O)N=C(S3)N)OCC(F)(F)F)C#N

Isomeric SMILES

C1=CC2=NC=C(C(=C2C=C1/C=C\3/C(=O)N=C(S3)N)OCC(F)(F)F)C#N

InChI

InChI=1S/C16H9F3N4O2S/c17-16(18,19)7-25-13-9(5-20)6-22-11-2-1-8(3-10(11)13)4-12-14(24)23-15(21)26-12/h1-4,6H,7H2,(H2,21,23,24)/b12-4-