ethyl 4-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)sulfanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)sulfanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)sulfanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)thio]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)sulfanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(5-carbethoxy-2,4-dimethyl-1H-pyrrol-3-yl)thio]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)SC2=C(NC(=C2C)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)SC2=C(NC(=C2C)C(=O)OCC)C)C

InChI

InChI=1S/C18H24N2O4S/c1-7-23-17(21)13-9(3)15(11(5)19-13)25-16-10(4)14(20-12(16)6)18(22)24-8-2/h19-20H,7-8H2,1-6H3