3-chloranyl-4-ethoxy-N-[[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-chloranyl-4-ethoxy-N-[[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide Openeye Name: 3-chloro-4-ethoxy-N-[[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide CAS Name: 3-chloro-4-ethoxy-N-[sulfanylidene-[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)anilino]methyl]benzamide IUPAC Name: 3-chloro-4-ethoxy-N-[[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide Traditional Name: 3-chloro-4-ethoxy-N-[[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]thiocarbamoyl]benzamide Formula: C19H15ClN6O2S2 MolecularWeight: 458.9444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NN4C=NN=C4S3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NN4C=NN=C4S3)Cl

InChI

InChI=1S/C19H15ClN6O2S2/c1-2-28-15-8-5-12(9-14(15)20)16(27)23-18(29)22-13-6-3-11(4-7-13)17-25-26-10-21-24-19(26)30-17/h3-10H,2H2,1H3,(H2,22,23,27,29)