N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-phenyl-triazole-4-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-phenyl-4-triazolecarboxamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-phenyltriazole-4-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-phenyl-triazole-4-carboxamide Formula: C17H13N5O3S2 MolecularWeight: 399.44682

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C17H13N5O3S2/c1-27(24,25)12-7-8-13-15(9-12)26-17(19-13)20-16(23)14-10-18-22(21-14)11-5-3-2-4-6-11/h2-10H,1H3,(H,19,20,23)