Vitas-M small molecule compound
2-[(4-methylbenzyl)sulfanyl]-3-(prop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK539904
SMILES C=CCn1c(SCc2ccc(cc2)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 C28H30N2OS MW 442.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2OS/c1-3-17-30-26(31)24-25(29-27(30)32-19-21-13-11-20(2)12-14-21)23-10-6-5-9-22(23)18-28(24)15-7-4-8-16-28/h3,5-6,9-14H,1,4,7-8,15-19H2,2H3InChIKey
PZUSPQBDJAMQJW-UHFFFAOYSA-NSynonyms
371116-22-22((4methylbenzyl)sulfanyl)3(prop2en1yl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((4METHYLPHENYL)METHYLSULFANYL)3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
371116222
3allyl2((4methylbenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2CC=C)C4(CCCCC4)CC5=CC=CC=C53
InChI=1SC28H30N2OSc13173026(31)2425(2927(30)321921131120(2)121421)231065922(23)1828(24)157481628h356914H14781519H22H3
MFCD03007502
ZINC000001779968
ZINC01779968
ZINC1779968
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