Vitas-M small molecule compound

ethyl 6-(2,4-dichlorophenyl)-4-phenyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate

Catalog ID
STK057142
SMILES CCOC(=O)C1=C(N=C(NC1c1ccc(cc1Cl)Cl)S)c1ccccc1

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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/c1-2-25-18(24)15-16(11-6-4-3-5-7-11)22-19(26)23-17(15)13-9-8-12(20)10-14(13)21/h3-10,17H,2H2,1H3,(H2,22,23,26)
InChIKey
XQZOWRVNCKHYRL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N=C(NC1c1ccc(cc1Cl)Cl)S)c1ccccc1
CCOC(=O)C1=C(NC(=S)NC1C2=C(C=C(C=C2)Cl)Cl)C3=CC=CC=C3
ETHYL4(24DICHLOROPHENYL)6PHENYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ETHYL6(24DICHLOROPHENYL)4PHENYL2SULFANYL16DIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC19H16Cl2N2O2Sc122518(24)1516(116435711)2219(26)2317(15)139812(20)1014(13)21h31017H2H21H3(H2222326)
MFCD04086021
STK057142
ZINC000006463325
ZINC000006463329

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Available files

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