Vitas-M small molecule compound
dimethyl 8-methyl-1-(3-methylphenyl)-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
Catalog ID
STL005709
SMILES COC(=O)C1=NN(C2(S1)SC(=C(N2c1ccccc1)C)C(=O)OC)c1cccc(c1)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 C22H21N3O4S2 MW 455.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4S2/c1-14-9-8-12-17(13-14)25-22(31-19(23-25)21(27)29-4)24(16-10-6-5-7-11-16)15(2)18(30-22)20(26)28-3/h5-13H,1-4H3InChIKey
XBHGMSPELLCDMX-UHFFFAOYSA-NSynonyms
670263-29-3670263293
CC1=CC(=CC=C1)N2C3(N(C(=C(S3)C(=O)OC)C)C4=CC=CC=C4)SC(=N2)C(=O)OC
DIMETHYL2METHYL6(3METHYLPHENYL)1PHENYL49DITHIA167TRIAZASPIRO(44)NONA27DIENE38DICARBOXYLATE
dimethyl8methyl1(3methylphenyl)9phenyl46dithia129triazaspiro(44)nona27diene37dicarboxylate
dimethyl8methyl4(3methylphenyl)9phenyl16dithia349triazaspiro(44)nona27diene27dicarboxylate
dimethyl8methyl9phenyl1(mtolyl)46dithia129triazaspiro(44)nona27diene37dicarboxylate
InChI=1SC22H21N3O4S2c114981217(1314)2522(3119(2325)21(27)294)24(16106571116)15(2)18(3022)20(26)283h513H14H3
MFCD04165114
ZINC000002411631
ZINC000002411632
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