Vitas-M small molecule compound
ethyl {[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetate
Catalog ID
STK832610
SMILES CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3
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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 C28H30N2O3S MW 474.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O3S/c1-3-33-23(31)18-34-27-29-25-22-10-6-5-9-20(22)17-28(15-7-4-8-16-28)24(25)26(32)30(27)21-13-11-19(2)12-14-21/h5-6,9-14H,3-4,7-8,15-18H2,1-2H3InChIKey
LUSIWEZJKVQSQA-UHFFFAOYSA-NSynonyms
289711-76-8289711768
CCOC(=O)CSC1=NC2=C(C(=O)N1C3=CC=C(C=C3)C)C4(CCCCC4)CC5=CC=CC=C52
ethyl((3(4methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetate
ethyl2((4oxo3(ptolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetate
ETHYL2(3(4METHYLPHENYL)4OXOSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YLTHIO)ACETATE
ETHYL2(3(4METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETATE
InChI=1SC28H30N2O3Sc133323(31)1834272925221065920(22)1728(157481628)24(25)26(32)30(27)21131119(2)121421h56914H34781518H212H3
MFCD00688841
ZINC000002346478
ZINC02346478
ZINC2346478
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