N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-[2-[(3R)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-[2-[(3R)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-[2-[(3R)-3-methyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-[[2-[(3R)-3-methyl-1-piperidinyl]-2-oxoethyl]thio]acetamide IUPAC Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-[2-[(3R)-3-methylpiperidin-1-yl]-2-oxoethyl]sulfanylacetamide Traditional Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-[[2-keto-2-[(3R)-3-methylpiperidino]ethyl]thio]acetamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)CSCC(=O)N3CCCC(C3)C)S2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)CSCC(=O)N3CCC[C@H](C3)C)S2)C

InChI

InChI=1S/C20H27N3O3S2/c1-4-26-15-7-8-16-17(10-15)28-20(22(16)3)21-18(24)12-27-13-19(25)23-9-5-6-14(2)11-23/h7-8,10,14H,4-6,9,11-13H2,1-3H3/t14-/m1/s1