Vitas-M small molecule compound
3-(2-methoxyphenyl)-2-[(3-methylbutyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK835245
SMILES COc1ccccc1n1c(SCCC(C)C)nc2c(c1=O)C1(CCCCC1)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 C29H34N2O2S MW 474.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O2S/c1-20(2)15-18-34-28-30-26-22-12-6-5-11-21(22)19-29(16-9-4-10-17-29)25(26)27(32)31(28)23-13-7-8-14-24(23)33-3/h5-8,11-14,20H,4,9-10,15-19H2,1-3H3InChIKey
FATMBZZUKPJWPS-UHFFFAOYSA-NSynonyms
2(isopentylthio)3(2methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2methoxyphenyl)2((3methylbutyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2METHOXYPHENYL)2(3METHYLBUTYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC(C)CCSC1=NC2=C(C(=O)N1C3=CC=CC=C3OC)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC29H34N2O2Sc120(2)1518342830262212651121(22)1929(1694101729)25(26)27(32)31(28)2313781424(23)333h58111420H49101519H213H3
MFCD01993009
ZINC000002293940
ZINC02293940
ZINC2293940
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