N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]acetamide IUPAC Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]acetamide Formula: C22H22BrN3O2S2 MolecularWeight: 504.46298

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CSCC(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CSCC(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C22H22BrN3O2S2/c1-2-25-18-10-9-16(23)12-19(18)30-22(25)24-20(27)13-29-14-21(28)26-11-5-7-15-6-3-4-8-17(15)26/h3-4,6,8-10,12H,2,5,7,11,13-14H2,1H3