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

Systemtic Name: 2-(phenylsulfonylamino)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(benzenesulfonamido)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-(benzenesulfonamido)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(benzenesulfonamido)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(benzenesulfonamido)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-1,3-benzothiazole-6-carboxamide Formula: C23H18N6O3S2 MolecularWeight: 490.55742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC=C(C=C4)CN5C=NC=N5

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC=C(C=C4)CN5C=NC=N5

InChI

InChI=1S/C23H18N6O3S2/c30-22(26-18-9-6-16(7-10-18)13-29-15-24-14-25-29)17-8-11-20-21(12-17)33-23(27-20)28-34(31,32)19-4-2-1-3-5-19/h1-12,14-15H,13H2,(H,26,30)(H,27,28)