Vitas-M small molecule compound
benzyl 4-(3,4-dichlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK812697
SMILES S=C1NC(=C(C(N1)c1ccc(c(c1)Cl)Cl)C(=O)OCc1ccccc1)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 C19H16Cl2N2O2S MW 407.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16Cl2N2O2S/c1-11-16(18(24)25-10-12-5-3-2-4-6-12)17(23-19(26)22-11)13-7-8-14(20)15(21)9-13/h2-9,17H,10H2,1H3,(H2,22,23,26)InChIKey
SCAAJUJHIIYDIP-UHFFFAOYSA-NSynonyms
BENZYL4(34DICHLOROPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
benzyl4(34dichlorophenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)Cl)Cl)C(=O)OCC3=CC=CC=C3
InChI=1SC19H16Cl2N2O2Sc11116(18(24)2510125324612)17(2319(26)2211)137814(20)15(21)913h2917H10H21H3(H2222326)
MFCD03132723
ZINC000004185172
ZINC000004185173
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