Vitas-M small molecule compound
2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Catalog ID
STK088532
SMILES C=CCn1c(SCC(=O)N)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1
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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 C21H23N3O2S MW 381.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O2S/c1-2-11-24-19(26)17-18(23-20(24)27-13-16(22)25)15-8-4-3-7-14(15)12-21(17)9-5-6-10-21/h2-4,7-8H,1,5-6,9-13H2,(H2,22,25)InChIKey
WWPHTRDLTBRCJP-UHFFFAOYSA-NSynonyms
2((4OXO3(PROP2EN1YL)46DIHYDRO3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTAN)2YL)SULFANYL)ACETAMIDE
2(4OXO3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETAMIDE
C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)N
C=CCn1c(SCC(=O)N)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1
InChI=1SC21H23N3O2Sc12112419(26)1718(2320(24)271316(22)25)15843714(15)1221(17)9561021h2478H156913H2(H22225)
MFCD01807029
STK088532
ZINC000004673243
ZINC04673243
ZINC4673243
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