N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]-3-(4-methoxyphenyl)propanamide

Systemtic Name: N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]-3-(4-methoxyphenyl)propanamide Openeye Name: N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]-3-(4-methoxyphenyl)propanamide CAS Name: N-[2-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]ethyl]-3-(4-methoxyphenyl)propanamide IUPAC Name: N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]-3-(4-methoxyphenyl)propanamide Traditional Name: N-[2-[4-(2-furoyl)piperazino]sulfonylethyl]-3-(4-methoxyphenyl)propionamide Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NCCS(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NCCS(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C21H27N3O6S/c1-29-18-7-4-17(5-8-18)6-9-20(25)22-10-16-31(27,28)24-13-11-23(12-14-24)21(26)19-3-2-15-30-19/h2-5,7-8,15H,6,9-14,16H2,1H3,(H,22,25)