3-[5-methyl-2-[(E)-2-[(Z)-[5-methyl-3-(3-sulfonatopropyl)benzothiazol-2-ylidene]methyl]but-1-enyl]benzothiazol-3-yl]propane-1-sulfonate; 1H-pyridine

Molecular Formula: C32H37N3O6S4


InChI: InChI=1/C27H32N2O6S4.C5H5N/c1-4-21(17-26-28(11-5-13-38(30,31)32)22-15-19(2)7-9-24(22)36-26)18-27-29(12-6-14-39(33,34)35)23-16-20(3)8-10-25(23)37-27;1-2-4-6-5-3-1/h7-10,15-18H,4-6,11-14H2,1-3H3,(H-,30,31,32,33,34,35);1-5H/fC27H31N2O6S4.C5H6N/h;6H/q-1;+1

InChIKey: InChIKey=DUPDXUZWXYURMJ-WFKPPSAZCJ
SMILES: CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)C)CCCS(=O)(=O)[O-])C=C3N(C4=C(S3)C=CC(=C4)C)CCCS(=O)(=O)[O-].C1=CC=[NH+]C=C1

Names:
    3-[5-methyl-2-[(E)-2-[(Z)-[5-methyl-3-(3-sulfonatopropyl)benzothiazol-2-ylidene]methyl]but-1-enyl]benzothiazol-3-yl]propane-1-sulfonate; 1H-pyridine

Registries:
    PubChem CID 5717934
    PubChem ID 3297794