Vitas-M small molecule compound
methyl 2-[({[5-(4-aminophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK724275
SMILES CCn1c(SCC(=O)Nc2ccccc2C(=O)OC)nnc1c1ccc(cc1)N
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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 C20H21N5O3S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3S/c1-3-25-18(13-8-10-14(21)11-9-13)23-24-20(25)29-12-17(26)22-16-7-5-4-6-15(16)19(27)28-2/h4-11H,3,12,21H2,1-2H3,(H,22,26)InChIKey
BEOINQGUMFPDJJ-UHFFFAOYSA-NSynonyms
500266-20-6500266206
CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(=O)OC)C3=CC=C(C=C3)N
InChI=1SC20H21N5O3Sc132518(1381014(21)11913)232420(25)291217(26)2216754615(16)19(27)282h411H31221H212H3(H2226)
methyl2((((5(4aminophenyl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL2((2((5(4AMINOPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl2(2((5(4aminophenyl)4ethyl4H124triazol3yl)thio)acetamido)benzoate
MFCD03490044
ZINC000000624543
ZINC00624543
ZINC624543
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