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1,4,5,8-tetrakis(azanyl)-2,6-bis(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione

1,4,5,8-tetrakis(azanyl)-2,6-bis(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione

Systemtic Name:1,4,5,8-tetrakis(azanyl)-2,6-bis(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione
Openeye Name:1,4,5,8-tetraamino-2,6-bis(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione
CAS Name:1,4,5,8-tetraamino-2,6-bis(1,3-benzothiazol-2-ylthio)anthracene-9,10-dione
IUPAC Name:1,4,5,8-tetraamino-2,6-bis(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione
Traditional Name:1,4,5,8-tetraamino-2,6-bis(1,3-benzothiazol-2-ylthio)-9,10-anthraquinone
Formula: C28H18N6O2S4
MolecularWeight: 598.74152
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=C(C4=C(C(=C3)N)C(=O)C5=C(C4=O)C(=CC(=C5N)SC6=NC7=CC=CC=C7S6)N)N


Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=C(C4=C(C(=C3)N)C(=O)C5=C(C4=O)C(=CC(=C5N)SC6=NC7=CC=CC=C7S6)N)N


InChI

InChI=1S/C28H18N6O2S4/c29-11-9-17(39-27-33-13-5-1-3-7-15(13)37-27)23(31)21-19(11)26(36)22-20(25(21)35)12(30)10-18(24(22)32)40-28-34-14-6-2-4-8-16(14)38-28/h1-10H,29-32H2


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