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

Systemtic Name: 3-methoxy-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-methoxy-N-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-methoxy-N-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-methoxy-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-methoxy-N-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O2S2/c1-26-17-10-5-8-15(12-17)19(25)22-20-23-24-21(28-20)27-13-16-9-4-7-14-6-2-3-11-18(14)16/h2-12H,13H2,1H3,(H,22,23,25)