Vitas-M small molecule compound
{1,4-dioxo-3-[3-(prop-2-en-1-yl)-1H-imidazol-3-ium-1-yl]-1,4-dihydronaphthalen-2-yl}(phenylsulfonyl)azanide
Catalog ID
STK565793
SMILES C=CC[n+]1ccn(c1)C1=C([N-]S(=O)(=O)c2ccccc2)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 C22H17N3O4S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4S/c1-2-12-24-13-14-25(15-24)20-19(23-30(28,29)16-8-4-3-5-9-16)21(26)17-10-6-7-11-18(17)22(20)27/h2-11,13-15H,1,12H2InChIKey
FPDJWKSBEFWKOH-UHFFFAOYSA-NSynonyms
1037567-91-1(14dioxo3(3(prop2en1yl)1Himidazol3ium1yl)14dihydronaphthalen2yl)(phenylsulfonyl)azanide
1037567911
3(BENZENESULFONYLIMINO)4OXO2(3PROP2ENYLIMIDAZOL3IUM1YL)NAPHTHALEN1OLATE
4OXO3((PHENYLSULFONYL)IMINO)2(3(PROP2EN1YL)1HIMIDAZOL3IUM1YL)34DIHYDRONAPHTHALEN1OLATE
C=CC(N+)1=CN(C=C1)C2=C(C3=CC=CC=C3C(=O)C2=NS(=O)(=O)C4=CC=CC=C4)(O)
C=CC(n+)1ccn(c1)C1=C((N)S(=O)(=O)c2ccccc2)C(=O)c2c(C1=O)cccc2
InChI=1SC22H17N3O4Sc121224131425(1524)2019(2330(2829)168435916)21(26)1710671118(17)22(20)27h2111315H112H2
MFCD03818431
ZINC000013596992
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