Vitas-M small molecule compound
ethyl 2-(1H-benzimidazol-2-ylsulfanyl)-3-(4-chlorophenyl)propanoate
Catalog ID
STK952991
SMILES CCOC(=O)C(Sc1nc2c([nH]1)cccc2)Cc1ccc(cc1)Cl
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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 C18H17ClN2O2S MW 360.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2O2S/c1-2-23-17(22)16(11-12-7-9-13(19)10-8-12)24-18-20-14-5-3-4-6-15(14)21-18/h3-10,16H,2,11H2,1H3,(H,20,21)InChIKey
RXZIAVVQZPCQAZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C(CC1=CC=C(C=C1)Cl)SC2=NC3=CC=CC=C3N2
CCOC(=O)C(Sc1nc2c((nH)1)cccc2)Cc1ccc(cc1)Cl
ETHYL(2R)2(1HBENZIMIDAZOL2YLSULFANYL)3(4CHLOROPHENYL)PROPANOATE
ETHYL(2S)2(1HBENZIMIDAZOL2YLSULFANYL)3(4CHLOROPHENYL)PROPANOATE
ethyl2(1Hbenzimidazol2ylsulfanyl)3(4chlorophenyl)propanoate
ETHYL2BENZIMIDAZOL2YLTHIO3(4CHLOROPHENYL)PROPANOATE
InChI=1SC18H17ClN2O2Sc122317(22)16(11127913(19)10812)24182014534615(14)2118h31016H211H21H3(H2021)
MFCD04208639
ZINC000001184796
ZINC000001184797
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