Vitas-M small molecule compound
diethyl 9'-ethoxy-5',5'-dimethyl-2',5-diphenyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
Catalog ID
STL412458
SMILES CCOc1ccc2c(c1)C1=C(C(N2)(C)C)SC(=C(C21SC(=C(S2)c1ccccc1)C(=O)OCC)c1ccccc1)C(=O)OCC
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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 C36H35NO5S3 MW 657.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H35NO5S3/c1-6-40-24-19-20-26-25(21-24)28-32(35(4,5)37-26)43-30(33(38)41-7-2)27(22-15-11-9-12-16-22)36(28)44-29(23-17-13-10-14-18-23)31(45-36)34(39)42-8-3/h9-21,37H,6-8H2,1-5H3InChIKey
IYBWWSZQJSIAPG-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)NC(C3=C2C4(C(=C(S3)C(=O)OCC)C5=CC=CC=C5)SC(=C(S4)C(=O)OCC)C6=CC=CC=C6)(C)C
diethyl9ethoxy55dimethyl25diphenyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)34dicarboxylate
diethyl9ethoxy55dimethyl25diphenyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)34dicarboxylate
DIETHYL9ETHOXY55DIMETHYL25DIPHENYLSPIRO(13DITHIOLE216HTHIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
InChI=1SC36H35NO5S3c16402419202625(2124)2832(35(45)3726)4330(33(38)4172)27(2215119121622)36(28)4429(23171310141823)31(4536)34(39)4283h92137H68H215H3
MFCD01562949
ZINC000150441216
ZINC000150441221
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