methyl 2-[[(E)-2-cyano-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-2-cyano-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoyl]amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-(1-ethyl-3,5-dimethyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-(1-ethyl-3,5-dimethylpyrazol-4-yl)prop-2-enoyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)acryloyl]amino]-5-isopropyl-thiophene-3-carboxylic acid methyl ester Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C=C(C#N)C(=O)NC2=C(C=C(S2)C(C)C)C(=O)OC)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)/C=C(\C#N)/C(=O)NC2=C(C=C(S2)C(C)C)C(=O)OC)C

InChI

InChI=1S/C20H24N4O3S/c1-7-24-13(5)15(12(4)23-24)8-14(10-21)18(25)22-19-16(20(26)27-6)9-17(28-19)11(2)3/h8-9,11H,7H2,1-6H3,(H,22,25)/b14-8+