Vitas-M small molecule compound

methyl 4-({[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STL026513
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C)c1ccccc1

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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 C19H18N4O3S MW 382.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O3S/c1-23-17(13-6-4-3-5-7-13)21-22-19(23)27-12-16(24)20-15-10-8-14(9-11-15)18(25)26-2/h3-11H,12H2,1-2H3,(H,20,24)
InChIKey
IYMMCHFENGXCHT-UHFFFAOYSA-N
Synonyms
333318-79-9
333318799
4(2(4METHYL5PHENYL4H(124)TRIAZOL3YLSULFANYL)ACETYLAMINO)BENZOICACIDMETHYLESTER
CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3
InChI=1SC19H18N4O3Sc12317(136435713)212219(23)271216(24)201510814(91115)18(25)262h311H12H212H3(H2024)
methyl4((((4methyl5phenyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((4METHYL5PHENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4(2((4METHYL5PHENYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZOATE
methyl4(2((4methyl5phenyl4H124triazol3yl)thio)acetamido)benzoate
METHYL4(2(4METHYL5PHENYL124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
MFCD02228905
ZINC000004977236
ZINC04977236
ZINC4977236

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Available files

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