2-naphthalen-2-yloxy-N-[5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-naphthalen-2-yloxy-N-[5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-(2-naphthyloxy)-N-[5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(2-naphthalenyloxy)-N-[5-[(4-nitrophenyl)methylthio]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-naphthalen-2-yloxy-N-[5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(2-naphthoxy)-N-[5-[(4-nitrobenzyl)thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C21H16N4O4S2 MolecularWeight: 452.50614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OCC(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OCC(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O4S2/c26-19(12-29-18-10-7-15-3-1-2-4-16(15)11-18)22-20-23-24-21(31-20)30-13-14-5-8-17(9-6-14)25(27)28/h1-11H,12-13H2,(H,22,23,26)