Vitas-M small molecule compound
[(4-bromophenyl)sulfonyl]{1,4-dioxo-3-[4-(3-phenylpropyl)pyridinium-1-yl]-1,4-dihydronaphthalen-2-yl}azanide
Catalog ID
STK547216
SMILES Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccc(cc2)CCCc2ccccc2)C(=O)c2c(C1=O)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H23BrN2O4S MW 587.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23BrN2O4S/c31-23-13-15-24(16-14-23)38(36,37)32-27-28(30(35)26-12-5-4-11-25(26)29(27)34)33-19-17-22(18-20-33)10-6-9-21-7-2-1-3-8-21/h1-5,7-8,11-20H,6,9-10H2InChIKey
QOWNAWCBMPQRSB-UHFFFAOYSA-NSynonyms
((4bromophenyl)sulfonyl)(14dioxo3(4(3phenylpropyl)pyridin1ium1yl)14dihydronaphthalen2yl)amide
((4bromophenyl)sulfonyl)(14dioxo3(4(3phenylpropyl)pyridinium1yl)14dihydronaphthalen2yl)azanide
3(((4BROMOPHENYL)SULFONYL)IMINO)4OXO2(4(3PHENYLPROPYL)PYRIDINIUM1YL)34DIHYDRONAPHTHALEN1OLATE
3(4BROMOPHENYL)SULFONYLIMINO4OXO2(4(3PHENYLPROPYL)PYRIDIN1IUM1YL)NAPHTHALEN1OLATE
Brc1ccc(cc1)S(=O)(=O)(N)C1=C((n+)2ccc(cc2)CCCc2ccccc2)C(=O)c2c(C1=O)cccc2
C1=CC=C(C=C1)CCCC2=CC=(N+)(C=C2)C3=C(C4=CC=CC=C4C(=O)C3=NS(=O)(=O)C5=CC=C(C=C5)Br)(O)
InChI=1SC30H23BrN2O4Sc3123131524(161423)38(3637)322728(30(35)2612541125(26)29(27)34)33191722(182033)1069217213821h15781120H6910H2
MFCD03662853
ZINC000001874476
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