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

Systemtic Name: 1,3-bis(oxidanylidene)-N-[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]-2-benzofuran-5-carboxamide Openeye Name: 1,3-dioxo-N-[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]isobenzofuran-5-carboxamide CAS Name: 1,3-dioxo-N-[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]-5-isobenzofurancarboxamide IUPAC Name: 1,3-dioxo-N-[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]-2-benzofuran-5-carboxamide Traditional Name: 1,3-diketo-N-[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]phthalan-5-carboxamide Formula: C17H12N4O4S2 MolecularWeight: 400.43158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)OC4=O

Isomeric SMILES

C1=CSC(=C1)CCNC2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)OC4=O

InChI

InChI=1S/C17H12N4O4S2/c22-13(9-3-4-11-12(8-9)15(24)25-14(11)23)19-17-21-20-16(27-17)18-6-5-10-2-1-7-26-10/h1-4,7-8H,5-6H2,(H,18,20)(H,19,21,22)