2-[[5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: 2-[[5-[(2-methyl-3-nitrophenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: 2-[[5-[(2-methyl-3-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-[(2-methyl-3-nitro-benzyl)thio]-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C12H12N4O3S3 MolecularWeight: 356.44368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NN=C(S2)SCC(=O)N

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NN=C(S2)SCC(=O)N

InChI

InChI=1S/C12H12N4O3S3/c1-7-8(3-2-4-9(7)16(18)19)5-20-11-14-15-12(22-11)21-6-10(13)17/h2-4H,5-6H2,1H3,(H2,13,17)