Vitas-M small molecule compound
8,8-dimethyl-6-(4-nitrophenyl)-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione
Catalog ID
STK582918
SMILES O=c1[nH]c2c(s1)C(C)(C)C1C(S2)C(=O)N(C1=O)c1ccc(cc1)[N+](=O)[O-]
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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 C16H13N3O5S2 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O5S2/c1-16(2)9-10(25-12-11(16)26-15(22)17-12)14(21)18(13(9)20)7-3-5-8(6-4-7)19(23)24/h3-6,9-10H,1-2H3,(H,17,22)InChIKey
IGZJBDDCPWTJQR-UHFFFAOYSA-NSynonyms
868237-59-6868237596
88dimethyl6(4nitrophenyl)34a7a8tetrahydropyrrolo(3456)thiopyrano(23d)(13)thiazole257(6H)trione
88dimethyl6(4nitrophenyl)4a7adihydro3Hpyrrolo(23)thiopyrano(45b)(13)thiazole257trione
88dimethyl6(4nitrophenyl)7a8dihydropyrrolo(3456)thiopyrano(23d)thiazole257(3H4aH6H)trione
CC1(C2C(C(=O)N(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))SC4=C1SC(=O)N4)C
InChI=1SC16H13N3O5S2c116(2)910(251211(16)2615(22)1712)14(21)18(13(9)20)7358(647)19(23)24h36910H12H3(H1722)
MFCD06440279
O=c1(nH)c2c(s1)C(C)(C)C1C(S2)C(=O)N(C1=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000005348435
ZINC000100986992
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