Vitas-M small molecule compound

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

Catalog ID
STK543260
SMILES CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SCc1ccc(cc1C)C)Cc1ccccc1

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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 C31H32N2OS MW 480.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2OS/c1-5-31(4)18-24-13-9-10-14-26(24)28-27(31)29(34)33(19-23-11-7-6-8-12-23)30(32-28)35-20-25-16-15-21(2)17-22(25)3/h6-17H,5,18-20H2,1-4H3
InChIKey
SIVTUFYUELGKAD-UHFFFAOYSA-N
Synonyms
488813-02-1
3benzyl2((24dimethylbenzyl)sulfanyl)5ethyl5methyl56dihydrobenzo(h)quinazolin4(3H)one
3benzyl2((24dimethylbenzyl)thio)5ethyl5methyl56dihydrobenzo(h)quinazolin4(3H)one
3BENZYL2((24DIMETHYLPHENYL)METHYLSULFANYL)5ETHYL5METHYL6HBENZO(H)QUINAZOLIN4ONE
488813021
CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC4=C(C=C(C=C4)C)C)CC5=CC=CC=C5)C
InChI=1SC31H32N2OSc1531(4)1824139101426(24)2827(31)29(34)33(1923117681223)30(3228)352025161521(2)1722(25)3h617H51820H214H3
MFCD03293645
ZINC000002360057
ZINC000002360058

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Available files

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