3-butoxy-N-[[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylanilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]thiocarbamoyl]benzamide Formula: C24H26N6O2S2 MolecularWeight: 494.63224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NN4C(=NN=C4S3)CC)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NN4C(=NN=C4S3)CC)C

InChI

InChI=1S/C24H26N6O2S2/c1-4-6-12-32-18-9-7-8-16(13-18)21(31)26-23(33)25-19-14-17(11-10-15(19)3)22-29-30-20(5-2)27-28-24(30)34-22/h7-11,13-14H,4-6,12H2,1-3H3,(H2,25,26,31,33)