Vitas-M small molecule compound
3-benzyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK844738
SMILES O=C(N1CCCCC1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C30H33N3O2S MW 499.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N3O2S/c34-25(32-17-9-2-10-18-32)21-36-29-31-27-24-14-6-5-13-23(24)19-30(15-7-8-16-30)26(27)28(35)33(29)20-22-11-3-1-4-12-22/h1,3-6,11-14H,2,7-10,15-21H2InChIKey
NEPMFDCMCOOBCX-UHFFFAOYSA-NSynonyms
799799-21-63benzyl2((2oxo2(piperidin1yl)ethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3benzyl2((2oxo2(piperidin1yl)ethyl)thio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3BENZYL2(2OXO2PIPERIDIN1YLETHYL)SULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
799799216
C1CCN(CC1)C(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)C5(CCCC5)CC6=CC=CC=C63
InChI=1SC30H33N3O2Sc3425(321792101832)21362931272414651323(24)1930(15781630)26(27)28(35)33(29)2022113141222h1361114H27101521H2
MFCD03677882
ZINC000002222046
ZINC02222046
ZINC2222046
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