methyl (4Z)-1,2-dimethyl-5-oxidanylidene-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-1,2-dimethyl-5-oxidanylidene-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate Openeye Name: methyl (4Z)-1,2-dimethyl-5-oxo-4-(2-thienylmethylene)pyrrole-3-carboxylate CAS Name: (4Z)-1,2-dimethyl-5-oxo-4-(thiophen-2-ylmethylidene)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-1,2-dimethyl-5-oxo-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate Traditional Name: (4Z)-5-keto-1,2-dimethyl-4-(2-thenylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=CS2)C(=O)N1C)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC=CS2)/C(=O)N1C)C(=O)OC

InChI

InChI=1S/C13H13NO3S/c1-8-11(13(16)17-3)10(12(15)14(8)2)7-9-5-4-6-18-9/h4-7H,1-3H3/b10-7-