Vitas-M small molecule compound

1-(4-methoxyphenyl)-4-oxo-6-sulfanyl-2-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carbonitrile

Catalog ID
STK950102
SMILES N#CC1=C(S)N(C(NC1=O)c1cccs1)c1ccc(cc1)OC

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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 C16H13N3O2S2 MW 343.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O2S2/c1-21-11-6-4-10(5-7-11)19-14(13-3-2-8-23-13)18-15(20)12(9-17)16(19)22/h2-8,14,22H,1H3,(H,18,20)
InChIKey
QDXYWUYNJODACL-UHFFFAOYSA-N
Synonyms

1(4methoxyphenyl)4oxo6sulfanyl2(thiophen2yl)1234tetrahydropyrimidine5carbonitrile
3(4METHOXYPHENYL)6OXO4SULFANYL2(2THIENYL)123TRIHYDROPYRIMIDINE5CARBONITRILE
3(4METHOXYPHENYL)6OXO4SULFANYL2THIOPHEN2YL12DIHYDROPYRIMIDINE5CARBONITRILE
COC1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC=CS3
InChI=1SC16H13N3O2S2c121116410(5711)1914(133282313)1815(20)12(917)16(19)22h281422H1H3(H1820)
MFCD05739286
ZINC000000352244
ZINC000004116942
ZINC00352244

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Available files

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