[3-cyclohexyl-1-(methylamino)-3-(2-methylfuran-3-yl)sulfanyl-propyl] 2-oxidanylpropanoate

Systemtic Name: [3-cyclohexyl-1-(methylamino)-3-(2-methylfuran-3-yl)sulfanyl-propyl] 2-oxidanylpropanoate Openeye Name: [3-cyclohexyl-1-(methylamino)-3-[(2-methyl-3-furyl)sulfanyl]propyl] 2-hydroxypropanoate CAS Name: 2-hydroxypropanoic acid [3-cyclohexyl-1-(methylamino)-3-[(2-methyl-3-furanyl)thio]propyl] ester IUPAC Name: [3-cyclohexyl-1-(methylamino)-3-(2-methylfuran-3-yl)sulfanylpropyl] 2-hydroxypropanoate Traditional Name: 2-hydroxypropionic acid [3-cyclohexyl-1-(methylamino)-3-[(2-methyl-3-furyl)thio]propyl] ester Formula: C18H29NO4S MolecularWeight: 355.49216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)SC(CC(NC)OC(=O)C(C)O)C2CCCCC2

Isomeric SMILES

CC1=C(C=CO1)SC(CC(NC)OC(=O)C(C)O)C2CCCCC2

InChI

InChI=1S/C18H29NO4S/c1-12(20)18(21)23-17(19-3)11-16(14-7-5-4-6-8-14)24-15-9-10-22-13(15)2/h9-10,12,14,16-17,19-20H,4-8,11H2,1-3H3