Vitas-M small molecule compound
2-amino-3-(1,3-benzothiazol-2-yl)-8-[(4-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STK561387
SMILES CC1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(N)c(c2=O)c1nc2c(s1)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 C23H23N3O3S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S/c1-13-8-10-26(11-9-13)12-15-17(27)7-6-14-20(28)19(22(24)29-21(14)15)23-25-16-4-2-3-5-18(16)30-23/h2-7,13,27H,8-12,24H2,1H3InChIKey
DFAHROFUJXBBLE-UHFFFAOYSA-NSynonyms
610759-77-82amino3(13benzothiazol2yl)8((4methylpiperidinium1yl)methyl)4oxo4Hchromen7olate
CC1CC(NH+)(CC1)Cc1c((O))ccc2c1oc(N)c(c2=O)c1nc2c(s1)cccc2
CC1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=NC5=CC=CC=C5S4)N)O
InChI=1SC23H23N3O3Sc11381026(11913)121517(27)761420(28)19(22(24)2921(14)15)232516423518(16)3023h271327H81224H21H3
MFCD03669242
ZINC000008691789
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