Vitas-M small molecule compound

N-(6-methyl-4-oxo-2-propyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3,3-diphenylpropanamide

Catalog ID
STK722128
SMILES CCCc1nc2sc3c(c2c(=O)n1NC(=O)CC(c1ccccc1)c1ccccc1)CC(CC3)C

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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 C29H31N3O2S MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O2S/c1-3-10-25-30-28-27(23-17-19(2)15-16-24(23)35-28)29(34)32(25)31-26(33)18-22(20-11-6-4-7-12-20)21-13-8-5-9-14-21/h4-9,11-14,19,22H,3,10,15-18H2,1-2H3,(H,31,33)
InChIKey
ZJAVTPLZHJXQCV-UHFFFAOYSA-N
Synonyms
372153-50-9
372153509
CCCC1=NC2=C(C3=C(S2)CCC(C3)C)C(=O)N1NC(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC29H31N3O2Sc131025302827(231719(2)151624(23)3528)29(34)32(25)3126(33)1822(20116471220)21138591421h4911141922H3101518H212H3(H3133)
MFCD01878295
N(6methyl4oxo2propyl5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)33diphenylpropanamide
N(6methyl4oxo2propyl5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)33diphenylpropanamide
N(6methyl4oxo2propyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin3(4H)yl)33diphenylpropanamide
ZINC000002274124
ZINC000002274125

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Available files

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