Vitas-M small molecule compound
(2-{(E)-[2-({[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
Catalog ID
STL362416
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)N/N=C/c1ccccc1OCC(=O)O
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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 C29H29N5O4S MW 543.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O4S/c1-29(2,3)22-15-13-20(14-16-22)27-32-33-28(34(27)23-10-5-4-6-11-23)39-19-25(35)31-30-17-21-9-7-8-12-24(21)38-18-26(36)37/h4-17H,18-19H2,1-3H3,(H,31,35)(H,36,37)/b30-17+InChIKey
COIBHOLJQGQTGX-OCSSWDANSA-NSynonyms
329910-96-5(2((E)(2(((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenoxy)aceticacid
(E)2(2((2(2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)acetyl)hydrazono)methyl)phenoxy)aceticacid
2(2((E)((2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)PHENOXY)ACETICACID
329910965
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC=CC=C4OCC(=O)O
InChI=1SC29H29N5O4Sc129(23)22151320(141622)27323328(34(27)23105461123)391925(35)313017219781224(21)381826(36)37h417H1819H213H3(H3135)(H3637)b3017+
MFCD02641934
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)NN=Cc1ccccc1OCC(=O)O
ZINC000002326799
ZINC4468613
Check stock
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Check stock on Vitas-MAvailable files
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