N-[3-ethanoyl-2-[3-methoxy-4-[(2-nitrophenyl)methoxy]phenyl]-2H-1,3,4-thiadiazol-5-yl]ethanamide

Systemtic Name: N-[3-ethanoyl-2-[3-methoxy-4-[(2-nitrophenyl)methoxy]phenyl]-2H-1,3,4-thiadiazol-5-yl]ethanamide Openeye Name: N-[3-acetyl-2-[3-methoxy-4-[(2-nitrophenyl)methoxy]phenyl]-2H-1,3,4-thiadiazol-5-yl]acetamide CAS Name: N-[3-acetyl-2-[3-methoxy-4-[(2-nitrophenyl)methoxy]phenyl]-2H-1,3,4-thiadiazol-5-yl]acetamide IUPAC Name: N-[3-acetyl-2-[3-methoxy-4-[(2-nitrophenyl)methoxy]phenyl]-2H-1,3,4-thiadiazol-5-yl]acetamide Traditional Name: N-[3-acetyl-2-[3-methoxy-4-(2-nitrobenzyl)oxy-phenyl]-2H-1,3,4-thiadiazol-5-yl]acetamide Formula: C20H20N4O6S MolecularWeight: 444.461

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN(C(S1)C2=CC(=C(C=C2)OCC3=CC=CC=C3[N+](=O)[O-])OC)C(=O)C

Isomeric SMILES

CC(=O)NC1=NN(C(S1)C2=CC(=C(C=C2)OCC3=CC=CC=C3[N+](=O)[O-])OC)C(=O)C

InChI

InChI=1S/C20H20N4O6S/c1-12(25)21-20-22-23(13(2)26)19(31-20)14-8-9-17(18(10-14)29-3)30-11-15-6-4-5-7-16(15)24(27)28/h4-10,19H,11H2,1-3H3,(H,21,22,25)