3-methyl-4-nitro-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 3-methyl-4-nitro-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-methyl-4-nitro-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-methyl-4-nitro-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-methyl-4-nitro-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 3-methyl-4-nitro-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C13H14N4O3S2 MolecularWeight: 338.40526

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H14N4O3S2/c1-3-6-21-13-16-15-12(22-13)14-11(18)9-4-5-10(17(19)20)8(2)7-9/h4-5,7H,3,6H2,1-2H3,(H,14,15,18)