N-[5-(1,3-benzodioxol-5-ylmethylamino)-1,3,4-thiadiazol-2-yl]-2-methoxy-benzamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethylamino)-1,3,4-thiadiazol-2-yl]-2-methoxy-benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethylamino)-1,3,4-thiadiazol-2-yl]-2-methoxy-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethylamino)-1,3,4-thiadiazol-2-yl]-2-methoxybenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethylamino)-1,3,4-thiadiazol-2-yl]-2-methoxybenzamide Traditional Name: 2-methoxy-N-[5-(piperonylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=NN=C(S2)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=NN=C(S2)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N4O4S/c1-24-13-5-3-2-4-12(13)16(23)20-18-22-21-17(27-18)19-9-11-6-7-14-15(8-11)26-10-25-14/h2-8H,9-10H2,1H3,(H,19,21)(H,20,22,23)