Vitas-M small molecule compound

3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-(propan-2-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one

Catalog ID
STK050601
SMILES CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1C1CCOC(C1)(C)C)CCCC3)C

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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 C26H34N2O2S MW 438.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2O2S/c1-17(2)31-24-27-22-20-10-6-5-9-18(20)15-26(12-7-8-13-26)21(22)23(29)28(24)19-11-14-30-25(3,4)16-19/h5-6,9-10,17,19H,7-8,11-16H2,1-4H3
InChIKey
SKZXANICXONOEJ-UHFFFAOYSA-N
Synonyms

3(22DIMETHYLOXAN4YL)2PROPAN2YLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
3(22dimethyltetrahydro2Hpyran4yl)2(isopropylthio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(22DIMETHYLTETRAHYDRO2HPYRAN4YL)2(PROPAN2YLSULFANYL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTAN)4(6H)ONE
CC(C)SC1=NC2=C(C(=O)N1C3CCOC(C3)(C)C)C4(CCCC4)CC5=CC=CC=C52
CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1C1CCOC(C1)(C)C)CCCC3)C
InChI=1SC26H34N2O2Sc117(2)31242722201065918(20)1526(12781326)21(22)23(29)28(24)1911143025(34)1619h569101719H781116H214H3
MFCD01559242
STK050601
ZINC000002254739
ZINC000002254740

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Available files

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