4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-nitro-benzamide

Systemtic Name: 4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-nitro-benzamide Openeye Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-nitro-benzamide CAS Name: 4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-3-nitrobenzamide IUPAC Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-nitrobenzamide Traditional Name: 4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-3-nitro-benzamide Formula: C10H9N5O3S2 MolecularWeight: 311.34016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CSC2=NN=C(S2)N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CSC2=NN=C(S2)N

InChI

InChI=1S/C10H9N5O3S2/c11-8(16)5-1-2-6(7(3-5)15(17)18)4-19-10-14-13-9(12)20-10/h1-3H,4H2,(H2,11,16)(H2,12,13)