methyl 5-[[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN2CCCC(C2)C3=NC4=CC=CC=C4S3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CN2CCC[C@H](C2)C3=NC4=CC=CC=C4S3)C(=O)OC

InChI

InChI=1S/C20H22N2O3S/c1-13-16(20(23)24-2)10-15(25-13)12-22-9-5-6-14(11-22)19-21-17-7-3-4-8-18(17)26-19/h3-4,7-8,10,14H,5-6,9,11-12H2,1-2H3/t14-/m1/s1