Vitas-M small molecule compound
ethyl [(4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetate
Catalog ID
STK045172
SMILES CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)[nH]1)CCCC3
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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 C20H22N2O3S MW 370.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3S/c1-2-25-15(23)12-26-19-21-17-14-8-4-3-7-13(14)11-20(9-5-6-10-20)16(17)18(24)22-19/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,21,22,24)InChIKey
OBCSKPUVONMVGP-UHFFFAOYSA-NSynonyms
331665-65-7331665657
CCOC(=O)CSC1=NC(=O)C2=C(N1)C3=CC=CC=C3CC24CCCC4
CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)(nH)1)CCCC3
ETHYL((4OXO46DIHYDRO3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTAN)2YL)SULFANYL)ACETATE
ethyl2((4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)acetate
ETHYL2(4OXOSPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETATE
InChI=1SC20H22N2O3Sc122515(23)122619211714843713(14)1120(9561020)16(17)18(24)2219h3478H256912H21H3(H212224)
MFCD00688868
STK045172
ZINC000018105533
ZINC18105533
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