N-[[3-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[3-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[3-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[3-(1H-benzimidazol-2-yl)anilino]-sulfanylidenemethyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[3-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[[3-(1H-benzimidazol-2-yl)phenyl]thiocarbamoyl]-5-nitro-benzothiophene-2-carboxamide Formula: C23H15N5O3S2 MolecularWeight: 473.5269

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H15N5O3S2/c29-22(20-12-14-11-16(28(30)31)8-9-19(14)33-20)27-23(32)24-15-5-3-4-13(10-15)21-25-17-6-1-2-7-18(17)26-21/h1-12H,(H,25,26)(H2,24,27,29,32)