Vitas-M small molecule compound
methyl 4-[5-({2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-1H-tetrazol-1-yl]benzoate
Catalog ID
STK761849
SMILES COC(=O)c1ccc(cc1)n1nnnc1SCC(=O)Nc1ccc(c(c1)C)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 C19H19N5O3S MW 397.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O3S/c1-12-4-7-15(10-13(12)2)20-17(25)11-28-19-21-22-23-24(19)16-8-5-14(6-9-16)18(26)27-3/h4-10H,11H2,1-3H3,(H,20,25)InChIKey
WGAIXHQCRLROGP-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)OC)C
InChI=1SC19H19N5O3Sc1124715(1013(12)2)2017(25)11281921222324(19)168514(6916)18(26)273h410H11H213H3(H2025)
methyl4(5((2((34dimethylphenyl)amino)2oxoethyl)sulfanyl)1Htetrazol1yl)benzoate
METHYL4(5(2(34DIMETHYLANILINO)2OXOETHYL)SULFANYLTETRAZOL1YL)BENZOATE
MFCD01871217
ZINC000000786069
ZINC00786069
ZINC786069
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Check stock on Vitas-MAvailable files
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