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

Systemtic Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxidanylidene-imidazolidin-4-yl)hexanamide Openeye Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxo-imidazolidin-4-yl)hexanamide CAS Name: N-[2-(1-benzotriazolylmethylthio)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxo-4-imidazolidinyl)hexanamide IUPAC Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide Traditional Name: N-[2-(benzotriazol-1-ylmethylthio)-1,3-benzothiazol-6-yl]-6-(2-keto-5-methyl-imidazolidin-4-yl)hexanamide Formula: C24H27N7O2S2 MolecularWeight: 509.64688

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(=O)N1)CCCCCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1C(NC(=O)N1)CCCCCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C24H27N7O2S2/c1-15-17(27-23(33)25-15)7-3-2-4-10-22(32)26-16-11-12-19-21(13-16)35-24(28-19)34-14-31-20-9-6-5-8-18(20)29-30-31/h5-6,8-9,11-13,15,17H,2-4,7,10,14H2,1H3,(H,26,32)(H2,25,27,33)