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

Systemtic Name: 3-ethoxy-4-methoxy-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-ethoxy-4-methoxy-benzamide CAS Name: 3-ethoxy-4-methoxy-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-ethoxy-4-methoxybenzamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-ethoxy-4-methoxy-benzamide Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)OC

InChI

InChI=1S/C19H19N3O3S2/c1-3-25-16-11-14(9-10-15(16)24-2)17(23)20-18-21-22-19(27-18)26-12-13-7-5-4-6-8-13/h4-11H,3,12H2,1-2H3,(H,20,21,23)