1,1'-DIETHYL-3-ETHYL-3'(SULFOBUTYL)-5,5'-DICYANO-BENZIMIDOTRIMETHINECYANINE-BETAINE


CAS No. : 109025-88-9

 1,1
Product Details
Cat No:M002959
Molecular Formula:C29H32N6O3S
Molecular Weight:544.674
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Cat No:M002959
Cas No:109025-88-9
Product-Name: 1,1'-DIETHYL-3-ETHYL-3'(SULFOBUTYL)-5,5'-DICYANO-BENZIMIDOTRIMETHINECYANINE-BETAINE
IUPAC Name:4-[6-cyano-2-[(E,3Z)-3-(5-cyano-1,3-diethylbenzimidazol-2-ylidene)prop-1-enyl]-3-ethylbenzimidazol-3-ium-1-yl]butane-1-sulfonate
InChI:InChI=1S/C29H32N6O3S/c1-4-32-24-14-12-22(20-30)18-26(24)34(6-3)28(32)10-9-11-29-33(5-2)25-15-13-23(21-31)19-27(25)35(29)16-7-8-17-39(36,37)38/h9-15,18-19H,4-8,16-17H2,1-3H3
InChIKey:YWYCGJBGMVFFMH-UHFFFAOYSA-N
SMILES:CCN1C2=C(C=C(C=C2)C#N)N(C1=CC=CC3=[N+](C4=C(N3CCCCS(=O)(=O)[O-])C=C(C=C4)C#N)CC)CC
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