methyl 2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonyl-5-methyl-furan-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonyl-5-methyl-furan-2-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]-5-methyl-furan-2-carbonyl]amino]benzoate CAS Name: 2-[[[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-5-methyl-2-furanyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonyl-5-methylfuran-2-carbonyl]amino]benzoate Traditional Name: 2-[[4-(3,5-dimethylpiperidino)sulfonyl-5-methyl-2-furoyl]amino]benzoic acid methyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=C(OC(=C2)C(=O)NC3=CC=CC=C3C(=O)OC)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=C(OC(=C2)C(=O)NC3=CC=CC=C3C(=O)OC)C)C

InChI

InChI=1S/C21H26N2O6S/c1-13-9-14(2)12-23(11-13)30(26,27)19-10-18(29-15(19)3)20(24)22-17-8-6-5-7-16(17)21(25)28-4/h5-8,10,13-14H,9,11-12H2,1-4H3,(H,22,24)