ethyl 4-methyl-5-oxidanylidene-3-phenylsulfanyl-[1,2]dithiolo[4,3-b]pyrrole-6-carboxylate

Systemtic Name: ethyl 4-methyl-5-oxidanylidene-3-phenylsulfanyl-[1,2]dithiolo[4,3-b]pyrrole-6-carboxylate Openeye Name: ethyl 4-methyl-5-oxo-3-phenylsulfanyl-dithiolo[4,3-b]pyrrole-6-carboxylate CAS Name: 4-methyl-5-oxo-3-(phenylthio)-6-dithiolo[4,3-b]pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-oxo-3-phenylsulfanyldithiolo[4,3-b]pyrrole-6-carboxylate Traditional Name: 5-keto-4-methyl-3-(phenylthio)dithiolo[4,3-b]pyrrole-6-carboxylic acid ethyl ester Formula: C15H13NO3S3 MolecularWeight: 351.46362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=C(SS2)SC3=CC=CC=C3)N(C1=O)C

Isomeric SMILES

CCOC(=O)C1=C2C(=C(SS2)SC3=CC=CC=C3)N(C1=O)C

InChI

InChI=1S/C15H13NO3S3/c1-3-19-14(18)10-12-11(16(2)13(10)17)15(22-21-12)20-9-7-5-4-6-8-9/h4-8H,3H2,1-2H3