N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-nitro-phenoxy)ethanamide

Systemtic Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-nitro-phenoxy)ethanamide Openeye Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-nitro-phenoxy)acetamide CAS Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-(2-methyl-4-nitrophenoxy)acetamide IUPAC Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-nitrophenoxy)acetamide Traditional Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-(2-methyl-4-nitro-phenoxy)acetamide Formula: C15H18N4O4S2 MolecularWeight: 382.45782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCCSC1=NN=C(S1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H18N4O4S2/c1-3-4-7-24-15-18-17-14(25-15)16-13(20)9-23-12-6-5-11(19(21)22)8-10(12)2/h5-6,8H,3-4,7,9H2,1-2H3,(H,16,17,20)