ethyl 3,5-dimethyl-4-[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[(E)-3-(3-methyl-2-thienyl)prop-2-enoyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[(E)-3-(3-methyl-2-thiophenyl)-1-oxoprop-2-enyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]-1H-pyrrole-2-carboxylate Traditional Name: 3,5-dimethyl-4-[(E)-3-(3-methyl-2-thienyl)acryloyl]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)C=CC2=C(C=CS2)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)/C=C/C2=C(C=CS2)C)C

InChI

InChI=1S/C17H19NO3S/c1-5-21-17(20)16-11(3)15(12(4)18-16)13(19)6-7-14-10(2)8-9-22-14/h6-9,18H,5H2,1-4H3/b7-6+