N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxidanylidene-imidazolidin-4-yl)hexanamide

Systemtic Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxidanylidene-imidazolidin-4-yl)hexanamide Openeye Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxo-imidazolidin-4-yl)hexanamide CAS Name: N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxo-4-imidazolidinyl)hexanamide IUPAC Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide Traditional Name: 6-(2-keto-5-methyl-imidazolidin-4-yl)-N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]hexanamide Formula: C21H30N4O4S2 MolecularWeight: 466.6173

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(=O)N1)CCCCCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCOCCOC

Isomeric SMILES

CC1C(NC(=O)N1)CCCCCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCOCCOC

InChI

InChI=1S/C21H30N4O4S2/c1-14-16(24-20(27)22-14)6-4-3-5-7-19(26)23-15-8-9-17-18(12-15)31-21(25-17)30-13-29-11-10-28-2/h8-9,12,14,16H,3-7,10-11,13H2,1-2H3,(H,23,26)(H2,22,24,27)