Vitas-M small molecule compound
2-[(2,4-dimethylbenzyl)sulfanyl]-3-(4-methylbenzyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK698955
SMILES Cc1ccc(cc1)Cn1c(SCc2ccc(cc2C)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 C34H36N2OS MW 520.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H36N2OS/c1-23-11-14-26(15-12-23)21-36-32(37)30-31(35-33(36)38-22-28-16-13-24(2)19-25(28)3)29-10-6-5-9-27(29)20-34(30)17-7-4-8-18-34/h5-6,9-16,19H,4,7-8,17-18,20-22H2,1-3H3InChIKey
GAUGYZCRWYWTKR-UHFFFAOYSA-NSynonyms
2((24dimethylbenzyl)sulfanyl)3(4methylbenzyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((24dimethylbenzyl)thio)3(4methylbenzyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((24DIMETHYLPHENYL)METHYLSULFANYL)3((4METHYLPHENYL)METHYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC1=CC=C(C=C1)CN2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC6=C(C=C(C=C6)C)C
InChI=1SC34H36N2OSc123111426(151223)213632(37)3031(3533(36)382228161324(2)1925(28)3)291065927(29)2034(30)177481834h5691619H47817182022H213H3
MFCD01807185
ZINC000001824953
ZINC01824953
ZINC1824953
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