Vitas-M small molecule compound
propyl 6-methyl-2-({[(2-phenylquinolin-4-yl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK301348
SMILES CCCOC(=O)c1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2ccccc2)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 C30H29N3O3S2 MW 543.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O3S2/c1-3-15-36-29(35)26-21-14-13-18(2)16-25(21)38-28(26)33-30(37)32-27(34)22-17-24(19-9-5-4-6-10-19)31-23-12-8-7-11-20(22)23/h4-12,17-18H,3,13-16H2,1-2H3,(H2,32,33,34,37)InChIKey
BLCOFILQUZTBAF-UHFFFAOYSA-NSynonyms
438613-66-2438613662
CCCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=S)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5
InChI=1SC30H29N3O3S2c13153629(35)2621141318(2)1625(21)3828(26)3330(37)3227(34)221724(1995461019)312312871120(22)23h4121718H31316H212H3(H232333437)
MFCD02604966
propyl6methyl2((((2phenylquinolin4yl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
propyl6methyl2((2phenylquinoline4carbonyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002727117
ZINC000002727118
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