Vitas-M small molecule compound
2-[(4-chlorobenzyl)sulfanyl]-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK549627
SMILES COc1cccc(c1)n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1
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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 C30H27ClN2O2S MW 515.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27ClN2O2S/c1-35-24-9-6-8-23(17-24)33-28(34)26-27(32-29(33)36-19-20-11-13-22(31)14-12-20)25-10-3-2-7-21(25)18-30(26)15-4-5-16-30/h2-3,6-14,17H,4-5,15-16,18-19H2,1H3InChIKey
JREWZSRLBDLRHJ-UHFFFAOYSA-NSynonyms
836637-57-12((4chlorobenzyl)sulfanyl)3(3methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2((4chlorobenzyl)thio)3(3methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2((4CHLOROPHENYL)METHYLSULFANYL)3(3METHOXYPHENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
836637571
COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC6=CC=C(C=C6)Cl
InChI=1SC30H27ClN2O2Sc1352496823(1724)3328(34)2627(3229(33)361920111322(31)141220)251032721(25)1830(26)15451630h2361417H4515161819H21H3
MFCD03689930
ZINC000009462302
ZINC09462302
ZINC9462302
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