dodecyl 2-(3-oxidanylidene-1-thiophen-2-ylcarbonyl-piperazin-2-yl)ethanoate

Systemtic Name: dodecyl 2-(3-oxidanylidene-1-thiophen-2-ylcarbonyl-piperazin-2-yl)ethanoate Openeye Name: dodecyl 2-[3-oxo-1-(thiophene-2-carbonyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo(thiophen-2-yl)methyl]-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[3-oxo-1-(thiophene-2-carbonyl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(2-thenoyl)piperazin-2-yl]acetic acid lauryl ester Formula: C23H36N2O4S MolecularWeight: 436.60794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CS2

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CS2

InChI

InChI=1S/C23H36N2O4S/c1-2-3-4-5-6-7-8-9-10-11-16-29-21(26)18-19-22(27)24-14-15-25(19)23(28)20-13-12-17-30-20/h12-13,17,19H,2-11,14-16,18H2,1H3,(H,24,27)