Vitas-M small molecule compound
3-benzyl-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STL296596
SMILES CCCCCSc1nc2c3ccccc3CC3(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 C28H32N2OS MW 444.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2OS/c1-2-3-11-18-32-27-29-25-23-15-8-7-14-22(23)19-28(16-9-10-17-28)24(25)26(31)30(27)20-21-12-5-4-6-13-21/h4-8,12-15H,2-3,9-11,16-20H2,1H3InChIKey
JDOBVCBMMTUNJD-UHFFFAOYSA-NSynonyms
337487-53-32PENTYLTHIO3BENZYLSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
337487533
3benzyl2(pentylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3benzyl2(pentylthio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3BENZYL2PENTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
CCCCCSC1=NC2=C(C(=O)N1CC3=CC=CC=C3)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC28H32N2OSc1231118322729252315871422(23)1928(169101728)24(25)26(31)30(27)2021125461321h481215H239111620H21H3
MFCD01876754
ZINC000002272039
ZINC02272039
ZINC2272039
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