Vitas-M small molecule compound
3-(2-phenylethyl)-2-(propylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK805028
SMILES CCCSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)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 C28H32N2OS MW 444.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2OS/c1-2-19-32-27-29-25-23-14-8-7-13-22(23)20-28(16-9-4-10-17-28)24(25)26(31)30(27)18-15-21-11-5-3-6-12-21/h3,5-8,11-14H,2,4,9-10,15-20H2,1H3InChIKey
WISPATAWFVYPAO-UHFFFAOYSA-NSynonyms
3(2phenylethyl)2(propylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2phenylethyl)2propylsulfanylspiro(6Hbenzo(h)quinazoline51cyclohexane)4one
3phenethyl2(propylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3PHENETHYL2PROPYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCCSC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC28H32N2OSc1219322729252314871322(23)2028(1694101728)24(25)26(31)30(27)181521115361221h3581114H249101520H21H3
MFCD01807187
ZINC000001808390
ZINC01808390
ZINC1808390
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