[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl] (E)-3-(3-chlorophenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl] (E)-3-(3-chlorophenyl)prop-2-enoate Openeye Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl] (E)-3-(3-chlorophenyl)prop-2-enoate CAS Name: (E)-3-(3-chlorophenyl)-2-propenoic acid [2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl] (E)-3-(3-chlorophenyl)prop-2-enoate Traditional Name: (E)-3-(3-chlorophenyl)acrylic acid [2-keto-2-[4-(2-thenoyl)piperazino]ethyl] ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC(=O)C=CC2=CC(=CC=C2)Cl)C(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)COC(=O)/C=C/C2=CC(=CC=C2)Cl)C(=O)C3=CC=CS3

InChI

InChI=1S/C20H19ClN2O4S/c21-16-4-1-3-15(13-16)6-7-19(25)27-14-18(24)22-8-10-23(11-9-22)20(26)17-5-2-12-28-17/h1-7,12-13H,8-11,14H2/b7-6+