N-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamothioyl]-4-nitro-benzamide

Systemtic Name: N-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamothioyl]-4-nitro-benzamide Openeye Name: N-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamothioyl]-4-nitro-benzamide CAS Name: N-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamothioyl]-4-nitrobenzamide Traditional Name: N-[(5-methyl-1,3,4-thiadiazol-2-yl)thiocarbamoyl]-4-nitro-benzamide Formula: C11H9N5O3S2 MolecularWeight: 323.35086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9N5O3S2/c1-6-14-15-11(21-6)13-10(20)12-9(17)7-2-4-8(5-3-7)16(18)19/h2-5H,1H3,(H2,12,13,15,17,20)