Vitas-M small molecule compound
6-methyl-4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
Catalog ID
STL084107
SMILES Cc1ccc2c(c1)N(CCO2)C(=O)Cn1c(=O)n(C)c(=O)c2c1nc(s2)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 C21H23N5O4S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O4S/c1-13-5-6-15-14(11-13)25(9-10-30-15)16(27)12-26-18-17(19(28)23(2)21(26)29)31-20(22-18)24-7-3-4-8-24/h5-6,11H,3-4,7-10,12H2,1-2H3InChIKey
RURGOVLLBVSNTJ-UHFFFAOYSA-NSynonyms
6methyl4(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)2pyrrolidin1yl(13)thiazolo(45d)pyrimidine57dione
6methyl4(2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl)2(pyrrolidin1yl)(13)thiazolo(45d)pyrimidine57(4H6H)dione
CC1=CC2=C(C=C1)OCCN2C(=O)CN3C4=C(C(=O)N(C3=O)C)SC(=N4)N5CCCC5
InChI=1SC21H23N5O4Sc113561514(1113)25(9103015)16(27)12261817(19(28)23(2)21(26)29)3120(2218)24734824h5611H3471012H212H3
MFCD18202677
ZINC000057520629
ZINC57520629
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