Vitas-M small molecule compound
methyl 2-({[2-(3-chlorophenyl)-3-methylquinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK422627
SMILES COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(C)c(nc2c1cccc2)c1cccc(c1)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 C27H23ClN2O3S MW 491.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClN2O3S/c1-15-22(18-10-3-5-12-20(18)29-24(15)16-8-7-9-17(28)14-16)25(31)30-26-23(27(32)33-2)19-11-4-6-13-21(19)34-26/h3,5,7-10,12,14H,4,6,11,13H2,1-2H3,(H,30,31)InChIKey
XDJQHUUTSGXUDK-UHFFFAOYSA-NSynonyms
CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)OC
InChI=1SC27H23ClN2O3Sc11522(1810351220(18)2924(15)1687917(28)1416)25(31)302623(27(32)332)1911461321(19)3426h357101214H461113H212H3(H3031)
methyl2(((2(3chlorophenyl)3methylquinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2(3chlorophenyl)3methylquinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02177196
ZINC000002768587
ZINC02768587
ZINC2768587
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