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

Systemtic Name: N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide Openeye Name: N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide CAS Name: N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide Traditional Name: N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]thiocarbamoyl]benzamide Formula: C18H14N6OS2 MolecularWeight: 394.47336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2N1N=C(S2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C2N1N=C(S2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H14N6OS2/c1-11-21-22-18-24(11)23-16(27-18)13-8-5-9-14(10-13)19-17(26)20-15(25)12-6-3-2-4-7-12/h2-10H,1H3,(H2,19,20,25,26)