Vitas-M small molecule compound
3-(4-methylphenyl)-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK542400
SMILES Cc1ccc(cc1)n1c(SCC(=O)N2CCCCC2)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 C31H35N3O2S MW 513.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35N3O2S/c1-22-12-14-24(15-13-22)34-29(36)27-28(32-30(34)37-21-26(35)33-18-8-3-9-19-33)25-11-5-4-10-23(25)20-31(27)16-6-2-7-17-31/h4-5,10-15H,2-3,6-9,16-21H2,1H3InChIKey
KITJEEYJLQVBOX-UHFFFAOYSA-NSynonyms
500144-88-72((2oxo2(piperidin1yl)ethyl)thio)3(ptolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4methylphenyl)2((2oxo2(piperidin1yl)ethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4METHYLPHENYL)2(2OXO2PIPERIDIN1YLETHYL)SULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
500144887
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)N6CCCCC6
InChI=1SC31H35N3O2Sc122121424(151322)3429(36)2728(3230(34)372126(35)33188391933)2511541023(25)2031(27)166271731h451015H23691621H21H3
MFCD03304470
ZINC000001895863
ZINC01895863
ZINC1895863
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