Vitas-M small molecule compound
6',6'-dimethyl-2'-(methylsulfanyl)-4-(thiophen-2-yl)-3,4,5',6'-tetrahydro-3'H-spiro[chromene-2,4'-pyrimidine]-7,8-diol
Catalog ID
STK682440
SMILES CSC1=NC(C)(C)CC2(N1)CC(c1cccs1)c1c(O2)c(O)c(cc1)O
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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 C19H22N2O3S2 MW 390.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O3S2/c1-18(2)10-19(21-17(20-18)25-3)9-12(14-5-4-8-26-14)11-6-7-13(22)15(23)16(11)24-19/h4-8,12,22-23H,9-10H2,1-3H3,(H,20,21)InChIKey
MBCPPOKJQJROEC-UHFFFAOYSA-NSynonyms
66dimethyl2(methylsulfanyl)4(thiophen2yl)3456tetrahydro3Hspiro(chromene24pyrimidine)78diol66dimethyl2methylsulfanyl4thiophen2ylspiro(15dihydropyrimidine4234dihydrochromene)78diol
CC1(CC2(CC(C3=C(O2)C(=C(C=C3)O)O)C4=CC=CS4)N=C(N1)SC)C
Registry IDs
MFCD03855927ZINC000005839948
ZINC000005840107
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