ethyl 7-methyl-6-oxidanylidene-2-sulfanylidene-3,5-dihydro-1H-pyrrolo[2,3-f]benzimidazole-7-carboxylate

Systemtic Name: ethyl 7-methyl-6-oxidanylidene-2-sulfanylidene-3,5-dihydro-1H-pyrrolo[2,3-f]benzimidazole-7-carboxylate Openeye Name: ethyl 7-methyl-6-oxo-2-thioxo-3,5-dihydro-1H-pyrrolo[2,3-f]benzimidazole-7-carboxylate CAS Name: 7-methyl-6-oxo-2-sulfanylidene-3,5-dihydro-1H-pyrrolo[2,3-f]benzimidazole-7-carboxylic acid ethyl ester IUPAC Name: ethyl 7-methyl-6-oxo-2-sulfanylidene-3,5-dihydro-1H-pyrrolo[2,3-f]benzimidazole-7-carboxylate Traditional Name: 6-keto-7-methyl-2-thioxo-3,5-dihydro-1H-pyrrolo[2,3-f]benzimidazole-7-carboxylic acid ethyl ester Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=CC3=C(C=C2NC1=O)NC(=S)N3)C

Isomeric SMILES

CCOC(=O)C1(C2=CC3=C(C=C2NC1=O)NC(=S)N3)C

InChI

InChI=1S/C13H13N3O3S/c1-3-19-11(18)13(2)6-4-8-9(16-12(20)15-8)5-7(6)14-10(13)17/h4-5H,3H2,1-2H3,(H,14,17)(H2,15,16,20)