Vitas-M small molecule compound
4-methoxy-N-({4-methyl-5-[(2-{[3-(methylsulfanyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)benzamide
Catalog ID
STK119267
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCC(=O)Nc1cccc(c1)SC
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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 C21H23N5O3S2 MW 457.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O3S2/c1-26-18(12-22-20(28)14-7-9-16(29-2)10-8-14)24-25-21(26)31-13-19(27)23-15-5-4-6-17(11-15)30-3/h4-11H,12-13H2,1-3H3,(H,22,28)(H,23,27)InChIKey
ZTTZPBVPLGKFOY-UHFFFAOYSA-NSynonyms
4METHOXYN((4METHYL5((2((3(METHYLSULFANYL)PHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
4METHOXYN((4METHYL5((2(3(METHYLSULFANYL)ANILINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
4METHOXYN((4METHYL5(2(3METHYLSULFANYLANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)SC)CNC(=O)C3=CC=C(C=C3)OC
InChI=1SC21H23N5O3S2c12618(122220(28)147916(292)10814)242521(26)311319(27)231554617(1115)303h411H1213H213H3(H2228)(H2327)
MFCD04128552
ZINC000000687365
ZINC00687365
ZINC687365
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