Vitas-M small molecule compound
methyl 1-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
Catalog ID
STL546440
SMILES COC(=O)C1NC(c2ccc(c(c2)CSc2nc3c(s2)cccc3)OC)c2c(C1)c1ccccc1[nH]2
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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 C28H25N3O3S2 MW 515.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O3S2/c1-33-23-12-11-16(13-17(23)15-35-28-31-21-9-5-6-10-24(21)36-28)25-26-19(14-22(30-25)27(32)34-2)18-7-3-4-8-20(18)29-26/h3-13,22,25,29-30H,14-15H2,1-2H3InChIKey
CTLOUEAWCJKJCV-UHFFFAOYSA-NSynonyms
1024016-12-31024016123
3727729
COC(=O)C1NC(c2ccc(c(c2)CSc2nc3c(s2)cccc3)OC)c2c(C1)c1ccccc1(nH)2
InChI=1SC28H25N3O3S2c13323121116(1317(23)15352831219561024(21)3628)252619(1422(3025)27(32)342)18734820(18)2926h31322252930H1415H212H3
methyl1(3((13benzothiazol2ylsulfanyl)methyl)4methoxyphenyl)2349tetrahydro1Hbetacarboline3carboxylate
methyl1(3((benzo(d)thiazol2ylthio)methyl)4methoxyphenyl)2349tetrahydro1Hpyrido(34b)indole3carboxylate
methyl1(3(13benzothiazol2ylsulfanylmethyl)4methoxyphenyl)2349tetrahydro1~(H)pyrido(34b)indole3carboxylate
MFCD02185689
ZINC000035883195
ZINC000035883207
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