Vitas-M small molecule compound
3-(3-methylphenyl)-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK541516
SMILES CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)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/c1-3-4-9-17-32-27-29-25-23-14-6-5-12-21(23)19-28(15-7-8-16-28)24(25)26(31)30(27)22-13-10-11-20(2)18-22/h5-6,10-14,18H,3-4,7-9,15-17,19H2,1-2H3InChIKey
TYHTZBUBVWZZGZ-UHFFFAOYSA-NSynonyms
487026-59-52(pentylthio)3(mtolyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(3methylphenyl)2(pentylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(3METHYLPHENYL)2PENTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
487026595
CCCCCSC1=NC2=C(C(=O)N1C3=CC=CC(=C3)C)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC28H32N2OSc134917322729252314651221(23)1928(15781628)24(25)26(31)30(27)2213101120(2)1822h56101418H3479151719H212H3
MFCD03286799
ZINC000001813470
ZINC01813470
ZINC1813470
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