N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-nitrophenoxy)ethanamide

Systemtic Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-nitrophenoxy)ethanamide Openeye Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-nitrophenoxy)acetamide CAS Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-(3-nitrophenoxy)acetamide IUPAC Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-nitrophenoxy)acetamide Traditional Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-(3-nitrophenoxy)acetamide Formula: C14H16N4O4S2 MolecularWeight: 368.43124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O4S2/c1-2-3-7-23-14-17-16-13(24-14)15-12(19)9-22-11-6-4-5-10(8-11)18(20)21/h4-6,8H,2-3,7,9H2,1H3,(H,15,16,19)