Vitas-M small molecule compound

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

Catalog ID
STL037088
SMILES CCC1(CC)Cc2ccccc2c2c1c(=O)n(c(n2)S)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 C23H24N2OS MW 376.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2OS/c1-3-23(4-2)14-17-12-8-9-13-18(17)20-19(23)21(26)25(22(27)24-20)15-16-10-6-5-7-11-16/h5-13H,3-4,14-15H2,1-2H3,(H,24,27)
InChIKey
HPSMVUKQHGMVSH-UHFFFAOYSA-N
Synonyms
312625-96-0
312625960
3benzyl55diethyl2sulfanyl56dihydrobenzo(h)quinazolin4(3H)one
3BENZYL55DIETHYL2SULFANYLIDENE16DIHYDROBENZO(H)QUINAZOLIN4ONE
CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=S)N3)CC4=CC=CC=C4)CC
InChI=1SC23H24N2OSc1323(42)141712891318(17)2019(23)21(26)25(22(27)2420)1516106571116h513H341415H212H3(H2427)
MFCD03812682
ZINC000004730716
ZINC04730716
ZINC4730716

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.