4-[4-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]-3-nitro-phenyl]sulfonylmorpholine Formula: C16H20N4O5S4 MolecularWeight: 476.6138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)SC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCCCSC1=NN=C(S1)SC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O5S4/c1-2-3-10-26-15-17-18-16(28-15)27-14-5-4-12(11-13(14)20(21)22)29(23,24)19-6-8-25-9-7-19/h4-5,11H,2-3,6-10H2,1H3