Vitas-M small molecule compound
methyl 4-[({[1-(3,4-dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL380103
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnnn1c1ccc(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/c1-12-4-9-16(10-13(12)2)24-19(21-22-23-24)28-11-17(25)20-15-7-5-14(6-8-15)18(26)27-3/h4-10H,11H2,1-3H3,(H,20,25)InChIKey
JTVPOLHMIRMYLS-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=CC=C(C=C3)C(=O)OC)C
InChI=1SC19H19N5O3Sc1124916(1013(12)2)2419(21222324)281117(25)20157514(6815)18(26)273h410H11H213H3(H2025)
methyl4((((1(34dimethylphenyl)1Htetrazol5yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2(1(34DIMETHYLPHENYL)TETRAZOL5YL)SULFANYLACETYL)AMINO)BENZOATE
MFCD03448696
ZINC000001122136
ZINC01122136
ZINC1122136
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.