Vitas-M small molecule compound
ethyl 4-[butyl({[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK523999
SMILES CCCCN(c1ccc(cc1)C(=O)OCC)C(=O)CSc1nnnn1c1c(C)cc(cc1C)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 C25H31N5O3S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O3S/c1-6-8-13-29(21-11-9-20(10-12-21)24(32)33-7-2)22(31)16-34-25-26-27-28-30(25)23-18(4)14-17(3)15-19(23)5/h9-12,14-15H,6-8,13,16H2,1-5H3InChIKey
KKYLEOCKEQIMPO-UHFFFAOYSA-NSynonyms
CCCCN(C1=CC=C(C=C1)C(=O)OCC)C(=O)CSC2=NN=NN2C3=C(C=C(C=C3C)C)C
ethyl4(butyl(((1(246trimethylphenyl)1Htetrazol5yl)sulfanyl)acetyl)amino)benzoate
ETHYL4(BUTYL(((1MESITYL1HTETRAAZOL5YL)THIO)ACETYL)AMINO)BENZOATE
ETHYL4(BUTYL(2(1(246TRIMETHYLPHENYL)TETRAZOL5YL)SULFANYLACETYL)AMINO)BENZOATE
InChI=1SC25H31N5O3Sc1681329(2111920(101221)24(32)3372)22(31)16342526272830(25)2318(4)1417(3)1519(23)5h9121415H681316H215H3
MFCD03764869
ZINC000002139010
ZINC02139010
ZINC2139010
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