ethyl 5-[(E)-(carbamothioylhydrazinylidene)methyl]-1H-pyrrolo[2,3-c]pyridine-2-carboxylate

Systemtic Name: ethyl 5-[(E)-(carbamothioylhydrazinylidene)methyl]-1H-pyrrolo[2,3-c]pyridine-2-carboxylate Openeye Name: ethyl 5-[(E)-(carbamothioylhydrazono)methyl]-1H-pyrrolo[2,3-c]pyridine-2-carboxylate CAS Name: 5-[(E)-(carbamothioylhydrazinylidene)methyl]-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-(carbamothioylhydrazinylidene)methyl]-1H-pyrrolo[2,3-c]pyridine-2-carboxylate Traditional Name: 5-[(E)-(thiocarbamoylhydrazono)methyl]-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid ethyl ester Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC(=NC=C2N1)C=NNC(=S)N

Isomeric SMILES

CCOC(=O)C1=CC2=CC(=NC=C2N1)/C=N/NC(=S)N

InChI

InChI=1S/C12H13N5O2S/c1-2-19-11(18)9-4-7-3-8(5-15-17-12(13)20)14-6-10(7)16-9/h3-6,16H,2H2,1H3,(H3,13,17,20)/b15-5+