2-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: 2-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]ethanamide Openeye Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]acetamide CAS Name: 2-[(6-amino-1,3-benzothiazol-2-yl)thio]-N-[2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]acetamide Traditional Name: 2-[(6-amino-1,3-benzothiazol-2-yl)thio]-N-[2-[[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]acetamide Formula: C27H25N5O2S4 MolecularWeight: 579.7797

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CSC4=NC5=C(S4)C=C(C=C5)N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CSC4=NC5=C(S4)C=C(C=C5)N)C

InChI

InChI=1S/C27H25N5O2S4/c1-3-16-6-4-5-15(2)25(16)32-24(34)14-36-27-31-20-10-8-18(12-22(20)38-27)29-23(33)13-35-26-30-19-9-7-17(28)11-21(19)37-26/h4-12H,3,13-14,28H2,1-2H3,(H,29,33)(H,32,34)