Vitas-M small molecule compound
N-cyclopropyl-1-(6-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-1H-pyrazole-3-carboxamide
Catalog ID
STL092881
SMILES O=C(N1CCOc2c1cc(C)cc2)CSc1ncnc(c1)n1ccc(n1)C(=O)NC1CC1
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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 C22H22N6O3S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O3S/c1-14-2-5-18-17(10-14)27(8-9-31-18)21(29)12-32-20-11-19(23-13-24-20)28-7-6-16(26-28)22(30)25-15-3-4-15/h2,5-7,10-11,13,15H,3-4,8-9,12H2,1H3,(H,25,30)InChIKey
FDWUQBXAMZMSLP-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)OCCN2C(=O)CSC3=NC=NC(=C3)N4C=CC(=N4)C(=O)NC5CC5
InChI=1SC22H22N6O3Sc114251817(1014)27(893118)21(29)1232201119(23132420)287616(2628)22(30)25153415h25710111315H348912H21H3(H2530)
MFCD18787084
Ncyclopropyl1(6((2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl)sulfanyl)pyrimidin4yl)1Hpyrazole3carboxamide
Ncyclopropyl1(6(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)sulfanylpyrimidin4yl)pyrazole3carboxamide
ZINC000067225643
ZINC67225643
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