methyl 2-[(E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoyl]oxypropanoate

Systemtic Name: methyl 2-[(E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoyl]oxypropanoate Openeye Name: methyl 2-[(E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enoyl]oxypropanoate CAS Name: 2-[(E)-1-oxo-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)prop-2-enoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[(E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoyl]oxypropanoate Traditional Name: 2-[(E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acryloyl]oxypropionic acid methyl ester Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC(=O)C=CC1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OC)OC(=O)/C=C/C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H18N2O4S/c1-14(20(24)25-2)26-18(23)11-10-15-13-22(16-7-4-3-5-8-16)21-19(15)17-9-6-12-27-17/h3-14H,1-2H3/b11-10+