Vitas-M small molecule compound
ethyl 4-[({[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK742998
SMILES CCOC(=O)c1ccc(cc1)NC(=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 C21H23N5O3S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O3S/c1-5-29-20(28)16-6-8-17(9-7-16)22-18(27)12-30-21-23-24-25-26(21)19-14(3)10-13(2)11-15(19)4/h6-11H,5,12H2,1-4H3,(H,22,27)InChIKey
GOYMSEXNAHYOME-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=NN2C3=C(C=C(C=C3C)C)C
ethyl4((((1(246trimethylphenyl)1Htetrazol5yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2(1(246TRIMETHYLPHENYL)TETRAZOL5YL)SULFANYLACETYL)AMINO)BENZOATE
InChI=1SC21H23N5O3Sc152920(28)166817(9716)2218(27)12302123242526(21)1914(3)1013(2)1115(19)4h611H512H214H3(H2227)
MFCD02637935
ZINC000000709805
ZINC00709805
ZINC709805
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