methyl 5-[(E)-2-cyano-3-thiophen-2-yl-prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[(E)-2-cyano-3-thiophen-2-yl-prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(E)-2-cyano-3-(2-thienyl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(E)-2-cyano-1-oxo-3-thiophen-2-ylprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-2-cyano-3-thiophen-2-ylprop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(E)-2-cyano-3-(2-thienyl)acryloyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(=CC2=CC=CS2)C#N

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)/C(=C/C2=CC=CS2)/C#N

InChI

InChI=1S/C16H14N2O3S/c1-9-13(16(20)21-3)10(2)18-14(9)15(19)11(8-17)7-12-5-4-6-22-12/h4-7,18H,1-3H3/b11-7+