Vitas-M small molecule compound

3-benzyl-5-ethyl-2-(hexylsulfanyl)-5-methyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one

Catalog ID
STK542842
SMILES CCCCCCSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)CC

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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 C28H34N2OS MW 446.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2OS/c1-4-6-7-13-18-32-27-29-25-23-17-12-11-16-22(23)19-28(3,5-2)24(25)26(31)30(27)20-21-14-9-8-10-15-21/h8-12,14-17H,4-7,13,18-20H2,1-3H3
InChIKey
WXPQIZLWFFKMDM-UHFFFAOYSA-N
Synonyms
488088-09-1
3benzyl5ethyl2(hexylsulfanyl)5methyl56dihydrobenzo(h)quinazolin4(3H)one
3benzyl5ethyl2(hexylthio)5methyl56dihydrobenzo(h)quinazolin4(3H)one
3BENZYL5ETHYL2HEXYLSULFANYL5METHYL6HBENZO(H)QUINAZOLIN4ONE
488088091
CCCCCCSC1=NC2=C(C(=O)N1CC3=CC=CC=C3)C(CC4=CC=CC=C42)(C)CC
InChI=1SC28H34N2OSc1467131832272925231712111622(23)1928(352)24(25)26(31)30(27)20211498101521h8121417H47131820H213H3
MFCD03287776
ZINC000002325164
ZINC000002325165

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Available files

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