S-(5-methyl-1,3,4-thiadiazol-2-yl) 3-nitrobenzenecarbothioate

Systemtic Name: S-(5-methyl-1,3,4-thiadiazol-2-yl) 3-nitrobenzenecarbothioate Openeye Name: S-(5-methyl-1,3,4-thiadiazol-2-yl) 3-nitrobenzenecarbothioate CAS Name: 3-nitrobenzenecarbothioic acid S-(5-methyl-1,3,4-thiadiazol-2-yl) ester IUPAC Name: S-(5-methyl-1,3,4-thiadiazol-2-yl) 3-nitrobenzenecarbothioate Traditional Name: 3-nitrothiobenzoic acid S-(5-methyl-1,3,4-thiadiazol-2-yl) ester Formula: C10H7N3O3S2 MolecularWeight: 281.31088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)SC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H7N3O3S2/c1-6-11-12-10(17-6)18-9(14)7-3-2-4-8(5-7)13(15)16/h2-5H,1H3