Vitas-M small molecule compound
N-{4-[4-benzyl-5-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Catalog ID
STK124910
SMILES O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1Cc1ccccc1)c1ccc(cc1)NC(=O)c1ccccc1
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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 C30H24ClN5O2S MW 554.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24ClN5O2S/c31-24-13-17-25(18-14-24)32-27(37)20-39-30-35-34-28(36(30)19-21-7-3-1-4-8-21)22-11-15-26(16-12-22)33-29(38)23-9-5-2-6-10-23/h1-18H,19-20H2,(H,32,37)(H,33,38)InChIKey
DWRIBXGZTZQWJG-UHFFFAOYSA-NSynonyms
C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5
InChI=1SC30H24ClN5O2Sc3124131725(181424)3227(37)203930353428(36(30)19217314821)22111526(161222)3329(38)2395261023h118H1920H2(H3237)(H3338)
MFCD03877643
N(4(4BENZYL5((2((4CHLOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)PHENYL)BENZAMIDE
N(4(4BENZYL5(2(4CHLOROANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)PHENYL)BENZAMIDE
ZINC000097995729
ZINC97995729
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