Vitas-M small molecule compound
methyl [2,2-dimethyl-8-oxo-5-(pyrrolidin-1-yl)-1,8-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-9(4H)-yl]acetate
Catalog ID
STK930389
SMILES COC(=O)Cn1nnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)N1CCCC1
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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 C20H23N5O4S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O4S/c1-20(2)8-11-12(10-29-20)17(24-6-4-5-7-24)21-18-14(11)15-16(30-18)19(27)25(23-22-15)9-13(26)28-3/h4-10H2,1-3H3InChIKey
DSDOIBGZGUHAAG-UHFFFAOYSA-NSynonyms
951979-68-3951979683
CC1(CC2=C3C4=C(C(=O)N(N=N4)CC(=O)OC)SC3=NC(=C2CO1)N5CCCC5)C
InChI=1SC20H23N5O4Sc120(2)81112(102920)17(24645724)211814(11)1516(3018)19(27)25(232215)913(26)283h410H213H3
methyl(22dimethyl8oxo5(pyrrolidin1yl)18dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)(123)triazin9(4H)yl)acetate
methyl2(22dimethyl8oxo5(pyrrolidin1yl)1Hpyrano(4345)pyrido(3245)thieno(32d)(123)triazin9(2H4H8H)yl)acetate
MFCD09858951
ZINC000013736076
ZINC13736076
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