N-[5-(2-acetamidoethylamino)-1,3,4-thiadiazol-2-yl]-1,3-bis(oxidanylidene)-2-benzofuran-5-carboxamide

Systemtic Name: N-[5-(2-acetamidoethylamino)-1,3,4-thiadiazol-2-yl]-1,3-bis(oxidanylidene)-2-benzofuran-5-carboxamide Openeye Name: N-[5-(2-acetamidoethylamino)-1,3,4-thiadiazol-2-yl]-1,3-dioxo-isobenzofuran-5-carboxamide CAS Name: N-[5-(2-acetamidoethylamino)-1,3,4-thiadiazol-2-yl]-1,3-dioxo-5-isobenzofurancarboxamide IUPAC Name: N-[5-(2-acetamidoethylamino)-1,3,4-thiadiazol-2-yl]-1,3-dioxo-2-benzofuran-5-carboxamide Traditional Name: N-[5-(2-acetamidoethylamino)-1,3,4-thiadiazol-2-yl]-1,3-diketo-phthalan-5-carboxamide Formula: C15H13N5O5S MolecularWeight: 375.35922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)OC3=O

Isomeric SMILES

CC(=O)NCCNC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)OC3=O

InChI

InChI=1S/C15H13N5O5S/c1-7(21)16-4-5-17-14-19-20-15(26-14)18-11(22)8-2-3-9-10(6-8)13(24)25-12(9)23/h2-3,6H,4-5H2,1H3,(H,16,21)(H,17,19)(H,18,20,22)