Vitas-M small molecule compound
6-nitro-3,4-bis(phenylsulfanyl)-2H-chromen-2-one
Catalog ID
STK329757
SMILES [O-][N+](=O)c1ccc2c(c1)c(Sc1ccccc1)c(c(=O)o2)Sc1ccccc1
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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 C21H13NO4S2 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13NO4S2/c23-21-20(28-16-9-5-2-6-10-16)19(27-15-7-3-1-4-8-15)17-13-14(22(24)25)11-12-18(17)26-21/h1-13HInChIKey
YHPMHPSBQNIGEN-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c(c1)c(Sc1ccccc1)c(c(=O)o2)Sc1ccccc1
6nitro34bis(phenylsulfanyl)2Hchromen2one
6NITRO34BIS(PHENYLSULFANYL)CHROMEN2ONE
6NITRO34BISPHENYLSULFANYLCHROMEN2ONE
6NITRO34DIPHENYLTHIOCHROMEN2ONE
C1=CC=C(C=C1)SC2=C(C(=O)OC3=C2C=C(C=C3)(N+)(=O)(O))SC4=CC=CC=C4
InChI=1SC21H13NO4S2c232120(281695261016)19(27157314815)171314(22(24)25)111218(17)2621h113H
MFCD00356100
ZINC000003018406
ZINC03018406
ZINC3018406
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