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

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-N-[3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]ethanamide Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-N-[3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]acetamide CAS Name: 2-[[2-(1-azepanyl)-2-oxoethyl]thio]-N-[3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]acetamide IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-N-[3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]acetamide Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-N-[3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]acetamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC=CC=C2SC1=NC(=O)CSCC(=O)N3CCCCCC3

Isomeric SMILES

COCCN1C2=CC=CC=C2SC1=NC(=O)CSCC(=O)N3CCCCCC3

InChI

InChI=1S/C20H27N3O3S2/c1-26-13-12-23-16-8-4-5-9-17(16)28-20(23)21-18(24)14-27-15-19(25)22-10-6-2-3-7-11-22/h4-5,8-9H,2-3,6-7,10-15H2,1H3