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

Systemtic Name: 4-ethoxy-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-ethoxy-N-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-ethoxy-N-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-ethoxy-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-ethoxy-N-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H19N3O2S2/c1-2-27-18-12-10-16(11-13-18)20(26)23-21-24-25-22(29-21)28-14-17-8-5-7-15-6-3-4-9-19(15)17/h3-13H,2,14H2,1H3,(H,23,24,26)