N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C19H13N3O4S2 MolecularWeight: 411.45422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

C1CC1C2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C19H13N3O4S2/c23-16-12-3-1-2-4-14(12)28(25,26)15-9-11(7-8-13(15)16)17(24)20-19-22-21-18(27-19)10-5-6-10/h1-4,7-10H,5-6H2,(H,20,22,24)