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

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)ethanamide Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)acetamide CAS Name: 2-[[2-(1-azepanyl)-2-oxoethyl]thio]-N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)acetamide IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)acetamide Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)acetamide Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)SC1=NC(=O)CSCC(=O)N3CCCCCC3

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)SC1=NC(=O)CSCC(=O)N3CCCCCC3

InChI

InChI=1S/C19H25N3O3S2/c1-21-15-8-7-14(25-2)11-16(15)27-19(21)20-17(23)12-26-13-18(24)22-9-5-3-4-6-10-22/h7-8,11H,3-6,9-10,12-13H2,1-2H3