N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide Formula: C23H17N5OS2 MolecularWeight: 443.54398

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H17N5OS2/c1-30-23-25-18-13-12-16(14-19(18)31-23)24-22(29)20-26-21(15-8-4-2-5-9-15)28(27-20)17-10-6-3-7-11-17/h2-14H,1H3,(H,24,29)