Vitas-M small molecule compound
3-{[(benzylsulfanyl)acetyl]amino}-4-chlorobenzoic acid
Catalog ID
STK329423
SMILES O=C(Nc1cc(ccc1Cl)C(=O)O)CSCc1ccccc1
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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 C16H14ClNO3S MW 335.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClNO3S/c17-13-7-6-12(16(20)21)8-14(13)18-15(19)10-22-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,18,19)(H,20,21)InChIKey
XIOOJCLQLMBYLS-UHFFFAOYSA-NSynonyms
3(((benzylsulfanyl)acetyl)amino)4chlorobenzoicacid
3((2benzylsulfanylacetyl)amino)4chlorobenzoicacid
C1=CC=C(C=C1)CSCC(=O)NC2=C(C=CC(=C2)C(=O)O)Cl
InChI=1SC16H14ClNO3Sc17137612(16(20)21)814(13)1815(19)10229114213511h18H910H2(H1819)(H2021)
MFCD09961892
ZINC000013167785
ZINC13167785
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