Vitas-M small molecule compound
4-(4-methoxynaphthalen-1-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL430854
SMILES COc1ccc(c2c1cccc2)C1NC(=S)NC(=C1C(=O)N)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 C17H17N3O2S MW 327.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O2S/c1-9-14(16(18)21)15(20-17(23)19-9)12-7-8-13(22-2)11-6-4-3-5-10(11)12/h3-8,15H,1-2H3,(H2,18,21)(H2,19,20,23)InChIKey
KNVAFSUJHKTEJH-UHFFFAOYSA-NSynonyms
4(4METHOXYNAPHTHALEN1YL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
4(4methoxynaphthalen1yl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
CC1=C(C(NC(=S)N1)C2=CC=C(C3=CC=CC=C23)OC)C(=O)N
InChI=1SC17H17N3O2Sc1914(16(18)21)15(2017(23)199)127813(222)11643510(11)12h3815H12H3(H21821)(H2192023)
MFCD02085655
ZINC000004574749
ZINC000004574750
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