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Vitas-M small molecule compound

diethyl 5',5',9'-trimethyl-6'-(phenylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate

Catalog ID
STK045726
SMILES CCOC(=O)C1=CC2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1)C(=O)Cc1ccccc1)SC=C(S2)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 C31H31NO5S3 MW 593.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31NO5S3/c1-6-36-28(34)23-17-31(38-18-24(40-31)29(35)37-7-2)26-21-15-19(3)13-14-22(21)32(30(4,5)27(26)39-23)25(33)16-20-11-9-8-10-12-20/h8-15,17-18H,6-7,16H2,1-5H3
InChIKey
YVKSSAGFBRNYOS-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC2(C3=C(S1)C(C)(C)N(c1c3cc(C)cc1)C(=O)Cc1ccccc1)SC=C(S2)C(=O)OCC
CCOC(=O)C1=CC2(C3=C(S1)C(N(C4=C3C=C(C=C4)C)C(=O)CC5=CC=CC=C5)(C)C)SC=C(S2)C(=O)OCC
DIETHYL(2R)559TRIMETHYL6(PHENYLACETYL)56DIHYDROSPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
DIETHYL(2S)559TRIMETHYL6(PHENYLACETYL)56DIHYDROSPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
diethyl559trimethyl6(2phenylacetyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)34dicarboxylate
DIETHYL559TRIMETHYL6(2PHENYLACETYL)SPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
DIETHYL559TRIMETHYL6(PHENYLACETYL)56DIHYDROSPIRO(13DITHIOLE21THIOPYRANO(23C)QUINOLINE)34DICARBOXYLATE
DIETHYL559TRIMETHYL6(PHENYLACETYL)56DIHYDROSPIRO(1HTHIOPYRANO(23C)QUINOLINE12(13)DITHIOLE)34DICARBOXYLATE
InChI=1SC31H31NO5S3c163628(34)231731(381824(4031)29(35)3772)26211519(3)131422(21)32(30(45)27(26)3923)25(33)16201198101220h8151718H6716H215H3
MFCD01975694
STK045726
ZINC000001863967
ZINC000001863968

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Available files

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