Vitas-M small molecule compound
6-chloro-6',6'-dimethyl-2-phenyl-2'-thioxo-2,2',3,3',5',6'-hexahydro-1'H-spiro[chromene-4,4'-pyrimidin]-7-yl acetate
Catalog ID
STK761459
SMILES CC(=O)Oc1cc2OC(CC3(c2cc1Cl)NC(=S)NC(C3)(C)C)c1ccccc1
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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 C22H23ClN2O3S MW 430.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O3S/c1-13(26)27-18-10-17-15(9-16(18)23)22(12-21(2,3)24-20(29)25-22)11-19(28-17)14-7-5-4-6-8-14/h4-10,19H,11-12H2,1-3H3,(H2,24,25,29)InChIKey
KBGCHKOUMZJVDC-UHFFFAOYSA-NSynonyms
(6chloro44dimethyl2phenyl2sulfanylidenespiro(13diazinane6423dihydrochromene)7yl)acetate
6chloro66dimethyl2phenyl2thioxo223356hexahydro1Hspiro(chromene44pyrimidin)7ylacetate
CC(=O)OC1=C(C=C2C(=C1)OC(CC23CC(NC(=S)N3)(C)C)C4=CC=CC=C4)Cl
InChI=1SC22H23ClN2O3Sc113(26)2718101715(916(18)23)22(1221(23)2420(29)2522)1119(2817)147546814h41019H1112H213H3(H2242529)
MFCD01926041
ZINC000001025537
ZINC000001025542
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