Vitas-M small molecule compound
1-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-6-methoxy-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid
Catalog ID
STL524903
SMILES COc1ccc2c(c1)c1CC(NC(c1[nH]2)c1ccc(c(c1)CSc1nc2c(s1)cccc2)OC)C(=O)O
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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 C28H25N3O4S2 MW 531.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O4S2/c1-34-17-8-9-20-18(12-17)19-13-22(27(32)33)30-25(26(19)29-20)15-7-10-23(35-2)16(11-15)14-36-28-31-21-5-3-4-6-24(21)37-28/h3-12,22,25,29-30H,13-14H2,1-2H3,(H,32,33)InChIKey
RHRZCIDHHVPAFM-UHFFFAOYSA-NSynonyms
1030938-58-91(3((13benzothiazol2ylsulfanyl)methyl)4methoxyphenyl)6methoxy2349tetrahydro1Hbetacarboline3carboxylicacid
1(3((benzo(d)thiazol2ylthio)methyl)4methoxyphenyl)6methoxy2349tetrahydro1Hpyrido(34b)indole3carboxylicacid
1(3(13benzothiazol2ylsulfanylmethyl)4methoxyphenyl)6methoxy2349tetrahydro1~(H)pyrido(34b)indole3carboxylicacid
1030938589
3718421
COc1ccc2c(c1)c1CC(NC(c1(nH)2)c1ccc(c(c1)CSc1nc2c(s1)cccc2)OC)C(=O)O
InChI=1SC28H25N3O4S2c13417892018(1217)191322(27(32)33)3025(26(19)2920)1571023(352)16(1115)1436283121534624(21)3728h31222252930H1314H212H3(H3233)
MFCD02115658
ZINC000002118996
ZINC000002119000
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