N-[(3-methyl-2H-benzo[g][1,3]benzothiazol-2-yl)carbamothioyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(3-methyl-2H-benzo[g][1,3]benzothiazol-2-yl)carbamothioyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(3-methyl-2H-benzo[g][1,3]benzothiazol-2-yl)carbamothioyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[(3-methyl-2H-benzo[g][1,3]benzothiazol-2-yl)amino]-sulfanylidenemethyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3-methyl-2H-benzo[g][1,3]benzothiazol-2-yl)carbamothioyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(3-methyl-2H-benzo[g][1,3]benzothiazol-2-yl)thiocarbamoyl]-5-nitro-benzothiophene-2-carboxamide Formula: C22H16N4O3S3 MolecularWeight: 480.58244

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(SC2=C1C=CC3=CC=CC=C32)NC(=S)NC(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

CN1C(SC2=C1C=CC3=CC=CC=C32)NC(=S)NC(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O3S3/c1-25-16-8-6-12-4-2-3-5-15(12)19(16)32-22(25)24-21(30)23-20(27)18-11-13-10-14(26(28)29)7-9-17(13)31-18/h2-11,22H,1H3,(H2,23,24,27,30)