N-[2-[[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxidanylidene-ethyl]-3-methyl-butanamide

Systemtic Name: N-[2-[[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxidanylidene-ethyl]-3-methyl-butanamide Openeye Name: N-[2-[[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxo-ethyl]-3-methyl-butanamide CAS Name: N-[2-[[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]amino]-2-oxoethyl]-3-methylbutanamide IUPAC Name: N-[2-[[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxoethyl]-3-methylbutanamide Traditional Name: N-[2-keto-2-[[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]amino]ethyl]-3-methyl-butyramide Formula: C18H25N3O4S2 MolecularWeight: 411.5388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCOCCOC

Isomeric SMILES

CC(C)CC(=O)NCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCOCCOC

InChI

InChI=1S/C18H25N3O4S2/c1-12(2)8-16(22)19-10-17(23)20-13-4-5-14-15(9-13)27-18(21-14)26-11-25-7-6-24-3/h4-5,9,12H,6-8,10-11H2,1-3H3,(H,19,22)(H,20,23)