Vitas-M small molecule compound

methyl 6-(3-iodo-5-methoxy-4-propoxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate

Catalog ID
STK119690
SMILES CCCOc1c(I)cc(cc1OC)C1NC(=NC(=C1C(=O)OC)C)S

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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 C17H21IN2O4S MW 476.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21IN2O4S/c1-5-6-24-15-11(18)7-10(8-12(15)22-3)14-13(16(21)23-4)9(2)19-17(25)20-14/h7-8,14H,5-6H2,1-4H3,(H2,19,20,25)
InChIKey
MDVJGNZZYHVQRW-UHFFFAOYSA-N
Synonyms

CCCOC1=C(C=C(C=C1I)C2C(=C(NC(=S)N2)C)C(=O)OC)OC
InChI=1SC17H21IN2O4Sc156241511(18)710(812(15)223)1413(16(21)234)9(2)1917(25)2014h7814H56H214H3(H2192025)
METHYL4(3IODO5METHOXY4PROPOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
METHYL6(3IODO5METHOXY4PROPOXYPHENYL)4METHYL2SULFANYL16DIHYDROPYRIMIDINE5CARBOXYLATE
MFCD03700159
ZINC000002184090
ZINC000002184091

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Available files

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