Vitas-M small molecule compound

methyl 2-chloro-5-({[(2-methylbenzyl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STK144834
SMILES COC(=O)c1cc(ccc1Cl)NC(=O)CSCc1ccccc1C

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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 C18H18ClNO3S MW 363.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClNO3S/c1-12-5-3-4-6-13(12)10-24-11-17(21)20-14-7-8-16(19)15(9-14)18(22)23-2/h3-9H,10-11H2,1-2H3,(H,20,21)
InChIKey
NMCLFRFEOMMBRX-UHFFFAOYSA-N
Synonyms

CC1=CC=CC=C1CSCC(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC
InChI=1SC18H18ClNO3Sc112534613(12)10241117(21)20147816(19)15(914)18(22)232h39H1011H212H3(H2021)
METHYL2CHLORO5((((2METHYLBENZYL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL2CHLORO5((2((2METHYLPHENYL)METHYLSULFANYL)ACETYL)AMINO)BENZOATE
MFCD04362982
ZINC000004685340
ZINC04685340
ZINC4685340

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Available files

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