Vitas-M small molecule compound
N-{1-[5-({2-[(5-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-2-methylpropyl}-3-methylbenzamide
Catalog ID
STK109671
SMILES O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1C)C(C(C)C)NC(=O)c1cccc(c1)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 C24H28ClN5O2S MW 486.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28ClN5O2S/c1-14(2)21(27-23(32)17-8-6-7-15(3)11-17)22-28-29-24(30(22)5)33-13-20(31)26-19-12-18(25)10-9-16(19)4/h6-12,14,21H,13H2,1-5H3,(H,26,31)(H,27,32)InChIKey
IFYUBIYGECJPDM-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=C(N2C)C(C(C)C)NC(=O)C3=CC(=CC=C3)C
InChI=1SC24H28ClN5O2Sc114(2)21(2723(32)1786715(3)1117)22282924(30(22)5)331320(31)26191218(25)10916(19)4h6121421H13H215H3(H2631)(H2732)
MFCD04126679
N(1(5((2((5CHLORO2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)2METHYLPROPYL)3METHYLBENZAMIDE
N(1(5(2(5CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)2METHYLPROPYL)3METHYLBENZAMIDE
ZINC000009763150
ZINC000009763151
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