Vitas-M small molecule compound
3-(3-methoxyphenyl)-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK530223
SMILES CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)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 C29H34N2O2S MW 474.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O2S/c1-3-4-10-18-34-28-30-26-24-15-7-6-12-21(24)20-29(16-8-5-9-17-29)25(26)27(32)31(28)22-13-11-14-23(19-22)33-2/h6-7,11-15,19H,3-5,8-10,16-18,20H2,1-2H3InChIKey
UERJOHFZAGIHLZ-UHFFFAOYSA-NSynonyms
3(3methoxyphenyl)2(pentylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(3methoxyphenyl)2(pentylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(3METHOXYPHENYL)2PENTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCCCCSC1=NC2=C(C(=O)N1C3=CC(=CC=C3)OC)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC29H34N2O2Sc1341018342830262415761221(24)2029(168591729)25(26)27(32)31(28)2213111423(1922)332h67111519H35810161820H212H3
MFCD02234981
ZINC000002293256
ZINC02293256
ZINC2293256
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