N-[5-(phenylsulfonylmethyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[5-(phenylsulfonylmethyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide Openeye Name: N-[5-(benzenesulfonylmethyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide CAS Name: N-[5-(benzenesulfonylmethyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide IUPAC Name: N-[5-(benzenesulfonylmethyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide Traditional Name: N-[5-(besylmethyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide Formula: C23H17N3O4S2 MolecularWeight: 463.52878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC2=NN=C(S2)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC2=NN=C(S2)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C23H17N3O4S2/c27-22(21-16-10-4-6-12-18(16)30-19-13-7-5-11-17(19)21)24-23-26-25-20(31-23)14-32(28,29)15-8-2-1-3-9-15/h1-13,21H,14H2,(H,24,26,27)