Vitas-M small molecule compound
methyl 4-[({[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL297219
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1ccc(cc1Cl)Cl
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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 C18H15Cl2N5O3S MW 452.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15Cl2N5O3S/c1-28-17(27)10-2-5-12(6-3-10)22-15(26)9-29-18-24-23-16(25(18)21)13-7-4-11(19)8-14(13)20/h2-8H,9,21H2,1H3,(H,22,26)InChIKey
OPYUHCQLLHODFU-UHFFFAOYSA-NSynonyms
843627-54-3843627543
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=C(C=C(C=C3)Cl)Cl
InChI=1SC18H15Cl2N5O3Sc12817(27)102512(6310)2215(26)92918242316(25(18)21)137411(19)814(13)20h28H921H21H3(H2226)
methyl4((((4amino5(24dichlorophenyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((4AMINO5(24DICHLOROPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl4(2((4amino5(24dichlorophenyl)4H124triazol3yl)thio)acetamido)benzoate
METHYL4(2(4AMINO5(24DICHLOROPHENYL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
MFCD04013977
ZINC000008645208
ZINC08645208
ZINC8645208
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