Vitas-M small molecule compound

ethyl 6-(2,3-dichlorophenyl)-4-phenyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate

Catalog ID
STK065350
SMILES CCOC(=O)C1=C(N=C(NC1c1cccc(c1Cl)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)14-16(11-7-4-3-5-8-11)22-19(26)23-17(14)12-9-6-10-13(20)15(12)21/h3-10,17H,2H2,1H3,(H2,22,23,26)
InChIKey
DIRNZRHLSSJQQK-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N=C(NC1c1cccc(c1Cl)Cl)S)c1ccccc1
CCOC(=O)C1=C(NC(=S)NC1C2=C(C(=CC=C2)Cl)Cl)C3=CC=CC=C3
ETHYL4(23DICHLOROPHENYL)6PHENYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ETHYL6(23DICHLOROPHENYL)4PHENYL2SULFANYL16DIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC19H16Cl2N2O2Sc122518(24)1416(117435811)2219(26)2317(14)12961013(20)15(12)21h31017H2H21H3(H2222326)
MFCD04085902
STK065350
ZINC000101012462
ZINC000101012465

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Available files

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