methyl 2-(2-chlorophenyl)-2-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-2-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]ethanoate Openeye Name: methyl 2-(2-chlorophenyl)-2-[4-[(E)-3-(2-thienyl)prop-2-enoyl]piperazin-1-yl]acetate CAS Name: 2-(2-chlorophenyl)-2-[4-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-2-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]acetate Traditional Name: 2-(2-chlorophenyl)-2-[4-[(E)-3-(2-thienyl)acryloyl]piperazino]acetic acid methyl ester Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)C=CC3=CC=CS3

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C20H21ClN2O3S/c1-26-20(25)19(16-6-2-3-7-17(16)21)23-12-10-22(11-13-23)18(24)9-8-15-5-4-14-27-15/h2-9,14,19H,10-13H2,1H3/b9-8+