2-[[2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-methyl-amino]-N-tert-butyl-ethanamide

Systemtic Name: 2-[[2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-methyl-amino]-N-tert-butyl-ethanamide Openeye Name: 2-[[2-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-methyl-amino]-N-tert-butyl-acetamide CAS Name: 2-[[2-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]-methylamino]-N-tert-butylacetamide IUPAC Name: 2-[[2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]-methylamino]-N-tert-butylacetamide Traditional Name: 2-[[2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]-methyl-amino]-N-tert-butyl-acetamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)CC(=O)N1CCCC(C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)CC(=O)N1CCC[C@H](C1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H30N4O2S/c1-21(2,3)23-18(26)13-24(4)14-19(27)25-11-7-8-15(12-25)20-22-16-9-5-6-10-17(16)28-20/h5-6,9-10,15H,7-8,11-14H2,1-4H3,(H,23,26)/t15-/m1/s1