Vitas-M small molecule compound

dimethyl 1-(4-methoxyphenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate

Catalog ID
STL001827
SMILES COc1ccc(cc1)N1N=C(SC21SC(=C(N2c1ccccc1)C)C(=O)OC)C(=O)OC

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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 C22H21N3O5S2 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5S2/c1-14-18(20(26)29-3)31-22(24(14)15-8-6-5-7-9-15)25(23-19(32-22)21(27)30-4)16-10-12-17(28-2)13-11-16/h5-13H,1-4H3
InChIKey
YQNPIEBBJCHONI-UHFFFAOYSA-N
Synonyms
670263-32-8
670263328
CC1=C(SC2(N1C3=CC=CC=C3)N(N=C(S2)C(=O)OC)C4=CC=C(C=C4)OC)C(=O)OC
dimethyl1(4methoxyphenyl)8methyl9phenyl46dithia129triazaspiro(44)nona27diene37dicarboxylate
dimethyl4(4methoxyphenyl)8methyl9phenyl16dithia349triazaspiro(44)nona27diene27dicarboxylate
DIMETHYL6(4METHOXYPHENYL)2METHYL1PHENYL49DITHIA167TRIAZASPIRO(44)NONA27DIENE38DICARBOXYLATE
InChI=1SC22H21N3O5S2c11418(20(26)293)3122(24(14)158657915)25(2319(3222)21(27)304)16101217(282)131116h513H14H3
MFCD04191311
ZINC000002427133
ZINC000002427134

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Available files

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