Vitas-M small molecule compound

methyl 1-{[(2,5-dichlorophenyl)sulfanyl]methyl}-1H-pyrazole-3-carboxylate

Catalog ID
STK964526
SMILES COC(=O)c1ccn(n1)CSc1cc(Cl)ccc1Cl

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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 C12H10Cl2N2O2S MW 317.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10Cl2N2O2S/c1-18-12(17)10-4-5-16(15-10)7-19-11-6-8(13)2-3-9(11)14/h2-6H,7H2,1H3
InChIKey
FRGLCWHKKRPYAJ-UHFFFAOYSA-N
Synonyms
1005673-14-2
1005673142
COC(=O)C1=NN(C=C1)CSC2=C(C=CC(=C2)Cl)Cl
InChI=1SC12H10Cl2N2O2Sc11812(17)104516(1510)7191168(13)239(11)14h26H7H21H3
methyl1(((25dichlorophenyl)sulfanyl)methyl)1Hpyrazole3carboxylate
METHYL1((25DICHLOROPHENYL)SULFANYLMETHYL)PYRAZOLE3CARBOXYLATE
METHYL1((25DICHLOROPHENYLTHIO)METHYL)PYRAZOLE3CARBOXYLATE
MFCD04050613
ZINC000002786286
ZINC02786286
ZINC2786286

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Available files

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