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

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)ethanamide Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)acetamide CAS Name: 2-[[2-(1-azepanyl)-2-oxoethyl]thio]-N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)acetamide IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)acetamide Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)acetamide Formula: C20H27N3O2S2 MolecularWeight: 405.57728

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C)SC1=NC(=O)CSCC(=O)N3CCCCCC3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C)SC1=NC(=O)CSCC(=O)N3CCCCCC3

InChI

InChI=1S/C20H27N3O2S2/c1-3-23-16-9-8-15(2)12-17(16)27-20(23)21-18(24)13-26-14-19(25)22-10-6-4-5-7-11-22/h8-9,12H,3-7,10-11,13-14H2,1-2H3