N-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-[4-(1,3-benzothiazol-2-ylsulfanylmethylamino)phenyl]sulfonyl-aniline

Systemtic Name: N-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-[4-(1,3-benzothiazol-2-ylsulfanylmethylamino)phenyl]sulfonyl-aniline Openeye Name: N-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-[4-(1,3-benzothiazol-2-ylsulfanylmethylamino)phenyl]sulfonyl-aniline CAS Name: N-[(1,3-benzothiazol-2-ylthio)methyl]-4-[4-[(1,3-benzothiazol-2-ylthio)methylamino]phenyl]sulfonylaniline IUPAC Name: N-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-[4-(1,3-benzothiazol-2-ylsulfanylmethylamino)phenyl]sulfonylaniline Traditional Name: (1,3-benzothiazol-2-ylthio)methyl-[4-[4-[(1,3-benzothiazol-2-ylthio)methylamino]phenyl]sulfonylphenyl]amine Formula: C28H22N4O2S5 MolecularWeight: 606.82488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCNC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)NCSC5=NC6=CC=CC=C6S5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCNC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)NCSC5=NC6=CC=CC=C6S5

InChI

InChI=1S/C28H22N4O2S5/c33-39(34,21-13-9-19(10-14-21)29-17-35-27-31-23-5-1-3-7-25(23)37-27)22-15-11-20(12-16-22)30-18-36-28-32-24-6-2-4-8-26(24)38-28/h1-16,29-30H,17-18H2