Vitas-M small molecule compound
methyl 4-[2-(6-methoxy-1,3-benzothiazol-2-yl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Catalog ID
STK595085
SMILES COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)C(=O)OC)c(=O)c1c(o2)cccc1
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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 C27H18N2O6S MW 498.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N2O6S/c1-33-16-11-12-18-20(13-16)36-27(28-18)29-22(14-7-9-15(10-8-14)26(32)34-2)21-23(30)17-5-3-4-6-19(17)35-24(21)25(29)31/h3-13,22H,1-2H3InChIKey
UJMKDRUQYGTBEF-UHFFFAOYSA-NSynonyms
874455-77-3874455773
COC1=CC2=C(C=C1)N=C(S2)N3C(C4=C(C3=O)OC5=CC=CC=C5C4=O)C6=CC=C(C=C6)C(=O)OC
InChI=1SC27H18N2O6Sc1331611121820(1316)3627(2818)2922(147915(10814)26(32)342)2123(30)17534619(17)3524(21)25(29)31h31322H12H3
methyl4(2(6methoxy13benzothiazol2yl)39dioxo1239tetrahydrochromeno(23c)pyrrol1yl)benzoate
METHYL4(2(6METHOXY13BENZOTHIAZOL2YL)39DIOXO1HCHROMENO(23C)PYRROL1YL)BENZOATE
methyl4(2(6methoxybenzo(d)thiazol2yl)39dioxo1239tetrahydrochromeno(23c)pyrrol1yl)benzoate
METHYL4(2(6METHOXYBENZOTHIAZOL2YL)39DIOXOCHROMENO(23C)3PYRROLINYL)BENZOATE
MFCD06610893
ZINC000002351411
ZINC000002351412
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