methyl 2-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate Openeye Name: methyl 2-[[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[(4-p-cumenylsulfonylpiperazino)methyl]furan-3-carboxylic acid methyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CO3)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CO3)C(=O)OC

InChI

InChI=1S/C20H26N2O5S/c1-15(2)16-4-6-17(7-5-16)28(24,25)22-11-9-21(10-12-22)14-19-18(8-13-27-19)20(23)26-3/h4-8,13,15H,9-12,14H2,1-3H3