ethyl 5-ethanoyl-4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[(E)-3-(1-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C=CC2=CN(N=C2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)/C=C/C2=CN(N=C2)C

InChI

InChI=1S/C17H19N3O4S/c1-5-24-17(23)14-10(2)15(11(3)21)25-16(14)19-13(22)7-6-12-8-18-20(4)9-12/h6-9H,5H2,1-4H3,(H,19,22)/b7-6+