Vitas-M small molecule compound
6-methyl-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-3-(2-methylpropyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Catalog ID
STL103846
SMILES Cc1ccc2c(c1)N(CCO2)C(=O)CSc1nc2cc([nH]c2c(=O)n1CC(C)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 C22H26N4O3S MW 426.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O3S/c1-13(2)11-26-21(28)20-16(10-15(4)23-20)24-22(26)30-12-19(27)25-7-8-29-18-6-5-14(3)9-17(18)25/h5-6,9-10,13,23H,7-8,11-12H2,1-4H3InChIKey
IGCMUVNJYOQYHL-UHFFFAOYSA-NSynonyms
6methyl2((2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl)sulfanyl)3(2methylpropyl)35dihydro4Hpyrrolo(32d)pyrimidin4one
6methyl2(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)sulfanyl3(2methylpropyl)5Hpyrrolo(32d)pyrimidin4one
CC1=CC2=C(C=C1)OCCN2C(=O)CSC3=NC4=C(C(=O)N3CC(C)C)NC(=C4)C
Cc1ccc2c(c1)N(CCO2)C(=O)CSc1nc2cc((nH)c2c(=O)n1CC(C)C)C
InChI=1SC22H26N4O3Sc113(2)112621(28)2016(1015(4)2320)2422(26)301219(27)257829186514(3)917(18)25h569101323H781112H214H3
MFCD20735448
ZINC000067237779
ZINC67237779
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