3-chloranyl-6-methoxy-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-methoxy-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-methoxy-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-methoxy-N-[[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-methoxy-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-methoxy-N-[[[2-(4-nitrophenoxy)acetyl]amino]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C19H15ClN4O6S2 MolecularWeight: 494.9286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H15ClN4O6S2/c1-29-12-6-7-13-14(8-12)32-17(16(13)20)18(26)21-19(31)23-22-15(25)9-30-11-4-2-10(3-5-11)24(27)28/h2-8H,9H2,1H3,(H,22,25)(H2,21,23,26,31)