Vitas-M small molecule compound
N-(2,5-dimethylphenyl)-2-[(4-ethyl-5-{[(4-methylphenyl)(methylsulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL365847
SMILES CCn1c(SCC(=O)Nc2cc(C)ccc2C)nnc1CN(S(=O)(=O)C)c1ccc(cc1)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 C23H29N5O3S2 MW 487.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O3S2/c1-6-27-21(14-28(33(5,30)31)19-11-8-16(2)9-12-19)25-26-23(27)32-15-22(29)24-20-13-17(3)7-10-18(20)4/h7-13H,6,14-15H2,1-5H3,(H,24,29)InChIKey
ZOMCBXMNGIRZHG-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C)C)CN(C3=CC=C(C=C3)C)S(=O)(=O)C
InChI=1SC23H29N5O3S2c162721(1428(33(530)31)1911816(2)91219)252623(27)321522(29)24201317(3)71018(20)4h713H61415H215H3(H2429)
MFCD14833760
N(25dimethylphenyl)2((4ethyl5(((4methylphenyl)(methylsulfonyl)amino)methyl)4H124triazol3yl)sulfanyl)acetamide
N(25dimethylphenyl)2((4ethyl5((4methylNmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)acetamide
ZINC000015019629
ZINC15019629
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