Vitas-M small molecule compound
N-{1-[5-({2-[(2,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]ethyl}-3-methylbenzamide
Catalog ID
STK140796
SMILES CCn1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1C(NC(=O)c1cccc(c1)C)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 C22H23Cl2N5O2S MW 492.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23Cl2N5O2S/c1-4-29-20(14(3)25-21(31)15-7-5-6-13(2)10-15)27-28-22(29)32-12-19(30)26-18-11-16(23)8-9-17(18)24/h5-11,14H,4,12H2,1-3H3,(H,25,31)(H,26,30)InChIKey
JTFYEODJLBKAEI-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)Cl)C(C)NC(=O)C3=CC(=CC=C3)C
InChI=1SC22H23Cl2N5O2Sc142920(14(3)2521(31)1575613(2)1015)272822(29)321219(30)26181116(23)8917(18)24h51114H412H213H3(H2531)(H2630)
MFCD04091250
N(1(5((2((25DICHLOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)3METHYLBENZAMIDE
N(1(5((2(25DICHLOROANILINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)3METHYLBENZAMIDE
N(1(5(2(25DICHLOROANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)3METHYLBENZAMIDE
ZINC000000661074
ZINC000000661076
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