2-(methylsulfonylamino)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(methylsulfonylamino)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(methanesulfonamido)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-(methanesulfonamido)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(methanesulfonamido)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(methanesulfonamido)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Formula: C18H16N6O3S2 MolecularWeight: 428.48804

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C18H16N6O3S2/c1-29(26,27)23-18-22-15-7-4-13(8-16(15)28-18)17(25)21-14-5-2-12(3-6-14)9-24-11-19-10-20-24/h2-8,10-11H,9H2,1H3,(H,21,25)(H,22,23)