Vitas-M small molecule compound
3-(furan-2-ylmethyl)-2-[(3-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK552819
SMILES Cc1cccc(c1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)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 C30H30N2O2S MW 482.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O2S/c1-21-9-7-10-22(17-21)20-35-29-31-27-25-13-4-3-11-23(25)18-30(14-5-2-6-15-30)26(27)28(33)32(29)19-24-12-8-16-34-24/h3-4,7-13,16-17H,2,5-6,14-15,18-20H2,1H3InChIKey
NCEXLGCGPBCYMX-UHFFFAOYSA-NSynonyms
799786-75-73(furan2ylmethyl)2((3methylbenzyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(furan2ylmethyl)2((3methylbenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(FURAN2YLMETHYL)2((3METHYLPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
799786757
CC1=CC(=CC=C1)CSC2=NC3=C(C(=O)N2CC4=CC=CO4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC30H30N2O2Sc121971022(1721)20352931272513431123(25)1830(145261530)26(27)28(33)32(29)1924128163424h347131617H25614151820H21H3
MFCD03675674
ZINC000002214277
ZINC02214277
ZINC2214277
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