Vitas-M small molecule compound
2-chloro-N-{1-[4-ethyl-5-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-3-methylbutyl}benzamide
Catalog ID
STK140027
SMILES CCc1ccc(cc1)NC(=O)CSc1nnc(n1CC)C(NC(=O)c1ccccc1Cl)CC(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 C26H32ClN5O2S MW 514.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32ClN5O2S/c1-5-18-11-13-19(14-12-18)28-23(33)16-35-26-31-30-24(32(26)6-2)22(15-17(3)4)29-25(34)20-9-7-8-10-21(20)27/h7-14,17,22H,5-6,15-16H2,1-4H3,(H,28,33)(H,29,34)InChIKey
ATCCTUUPTADZOC-UHFFFAOYSA-NSynonyms
2CHLORON(1(4ETHYL5((2((4ETHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)3METHYLBUTYL)BENZAMIDE
2CHLORON(1(4ETHYL5(2(4ETHYLANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)3METHYLBUTYL)BENZAMIDE
CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C(CC(C)C)NC(=O)C3=CC=CC=C3Cl
InChI=1SC26H32ClN5O2Sc1518111319(141218)2823(33)163526313024(32(26)62)22(1517(3)4)2925(34)209781021(20)27h7141722H561516H214H3(H2833)(H2934)
MFCD04211878
ZINC000009601208
ZINC000009601209
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