methyl 2-[[(E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-1-oxoprop-2-enyl]amino]-5-propyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoyl]amino]-5-propylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]acryloyl]amino]-5-propyl-thiophene-3-carboxylic acid methyl ester Formula: C24H24N4O3S MolecularWeight: 448.53736

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)C(=CC2=C(NN=C2)C3=CC=C(C=C3)CC)C#N)C(=O)OC

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)/C(=C/C2=C(NN=C2)C3=CC=C(C=C3)CC)/C#N)C(=O)OC

InChI

InChI=1S/C24H24N4O3S/c1-4-6-19-12-20(24(30)31-3)23(32-19)27-22(29)17(13-25)11-18-14-26-28-21(18)16-9-7-15(5-2)8-10-16/h7-12,14H,4-6H2,1-3H3,(H,26,28)(H,27,29)/b17-11+