Vitas-M small molecule compound
ethyl 6-methyl-2-{[({2-[3-(propan-2-yloxy)phenyl]quinolin-4-yl}carbonyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK317669
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)OC(C)C)sc2c1CCC(C2)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 C32H33N3O4S2 MW 587.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3O4S2/c1-5-38-31(37)28-23-14-13-19(4)15-27(23)41-30(28)35-32(40)34-29(36)24-17-26(33-25-12-7-6-11-22(24)25)20-9-8-10-21(16-20)39-18(2)3/h6-12,16-19H,5,13-15H2,1-4H3,(H2,34,35,36,40)InChIKey
WGANKTQYNPIRIN-UHFFFAOYSA-NSynonyms
445237-19-4445237194
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=S)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)OC(C)C
ethyl6methyl2((((2(3(propan2yloxy)phenyl)quinolin4yl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6methyl2((2(3propan2yloxyphenyl)quinoline4carbonyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC32H33N3O4S2c153831(37)2823141319(4)1527(23)4130(28)3532(40)3429(36)241726(332512761122(24)25)20981021(1620)3918(2)3h6121619H51315H214H3(H234353640)
MFCD02608539
ZINC000002108547
ZINC000002108551
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