Vitas-M small molecule compound
methyl 2-({methyl[(1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]carbamothioyl}amino)benzoate
Catalog ID
STK642712
SMILES COC(=O)c1ccccc1NC(=S)N(Cc1cc2ccccc2n(c1=O)C)C
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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 C21H21N3O3S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S/c1-23(21(28)22-17-10-6-5-9-16(17)20(26)27-3)13-15-12-14-8-4-7-11-18(14)24(2)19(15)25/h4-12H,13H2,1-3H3,(H,22,28)InChIKey
JAHABXZYKSRLQM-UHFFFAOYSA-NSynonyms
1010886-32-41010886324
CN1C2=CC=CC=C2C=C(C1=O)CN(C)C(=S)NC3=CC=CC=C3C(=O)OC
InChI=1SC21H21N3O3Sc123(21(28)22171065916(17)20(26)273)131512148471118(14)24(2)19(15)25h412H13H213H3(H2228)
methyl2((methyl((1methyl2oxo12dihydroquinolin3yl)methyl)carbamothioyl)amino)benzoate
methyl2((methyl((1methyl2oxoquinolin3yl)methyl)carbamothioyl)amino)benzoate
methyl2(3methyl3((1methyl2oxo12dihydroquinolin3yl)methyl)thioureido)benzoate
MFCD12201538
ZINC000012324349
ZINC12324349
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