Vitas-M small molecule compound
8'-ethyl-4',4',6'-trimethyl-6'-phenyl-5',6'-dihydro-3H,4'H-spiro[1,3-benzothiazole-2,1'-pyrrolo[3,2,1-ij]quinolin]-2'-one
Catalog ID
STK217517
SMILES CCc1cc2c3c(c1)C1(Nc4c(S1)cccc4)C(=O)N3C(CC2(C)c1ccccc1)(C)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 C28H28N2OS MW 440.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2OS/c1-5-18-15-20-24-21(16-18)28(29-22-13-9-10-14-23(22)32-28)25(31)30(24)26(2,3)17-27(20,4)19-11-7-6-8-12-19/h6-16,29H,5,17H2,1-4H3InChIKey
YJBPAXNOMNBLQI-UHFFFAOYSA-NSynonyms
774561-54-5774561545
8ethyl446trimethyl6phenyl56dihydro3H4Hspiro(13benzothiazole21pyrrolo(321ij)quinolin)2one
8ethyl446trimethyl6phenyl56dihydro3Hspiro(benzo(d)thiazole21pyrrolo(321ij)quinolin)2(4H)one
CCC1=CC2=C3C(=C1)C(CC(N3C(=O)C24NC5=CC=CC=C5S4)(C)C)(C)C6=CC=CC=C6
InChI=1SC28H28N2OSc151815202421(1618)28(2922139101423(22)3228)25(31)30(24)26(23)1727(204)19117681219h61629H517H214H3
MFCD06594520
ZINC000002194898
ZINC000002194903
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