Vitas-M small molecule compound
12,12-dimethyl-7-[(4-nitrobenzyl)sulfanyl]-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Catalog ID
STK600145
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C
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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 C20H17N7O3S2 MW 467.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N7O3S2/c1-20(2)7-13-14(8-30-20)32-17-15(13)16-21-10-22-26(16)18-23-24-19(25(17)18)31-9-11-3-5-12(6-4-11)27(28)29/h3-6,10H,7-9H2,1-2H3InChIKey
YFOLDFXOMUNVPY-UHFFFAOYSA-NSynonyms
862485-07-2(O)(N+)(=O)c1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C
1212dimethyl7((4nitrobenzyl)sulfanyl)1213dihydro10Hpyrano(4345)thieno(32e)bis(124)triazolo(43a15c)pyrimidine
1212dimethyl7((4nitrobenzyl)thio)1213dihydro10Hpyrano(4345)thieno(32e)bis((124)triazolo)(43a15c)pyrimidine
862485072
CC1(CC2=C(CO1)SC3=C2C4=NC=NN4C5=NN=C(N35)SCC6=CC=C(C=C6)(N+)(=O)(O))C
InChI=1SC20H17N7O3S2c120(2)71314(83020)321715(13)1621102226(16)18232419(25(17)18)319113512(6411)27(28)29h3610H79H212H3
MFCD05698643
ZINC000009292402
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