Vitas-M small molecule compound
3-cyclohexyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK741134
SMILES O=C(c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCCC3
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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 C31H34N2O2S MW 498.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O2S/c34-26(22-12-4-1-5-13-22)21-36-30-32-28-25-17-9-8-14-23(25)20-31(18-10-3-11-19-31)27(28)29(35)33(30)24-15-6-2-7-16-24/h1,4-5,8-9,12-14,17,24H,2-3,6-7,10-11,15-16,18-21H2InChIKey
VEJBBEQMOPRBJI-UHFFFAOYSA-NSynonyms
3cyclohexyl2((2oxo2phenylethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3cyclohexyl2((2oxo2phenylethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3CYCLOHEXYL2PHENACYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
C1CCC(CC1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)C6=CC=CC=C6
InChI=1SC31H34N2O2Sc3426(22124151322)21363032282517981423(25)2031(18103111931)27(28)29(35)33(30)24156271624h1458912141724H2367101115161821H2
MFCD01558983
ZINC000002299041
ZINC02299041
ZINC2299041
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