Vitas-M small molecule compound
4-tert-butyl-N-[4-(4-methyl-5-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]benzamide
Catalog ID
STL357647
SMILES O=C(Nc1ccccc1)CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccc(cc1)C(C)(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 C28H29N5O2S MW 499.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O2S/c1-28(2,3)21-14-10-20(11-15-21)26(35)30-23-16-12-19(13-17-23)25-31-32-27(33(25)4)36-18-24(34)29-22-8-6-5-7-9-22/h5-17H,18H2,1-4H3,(H,29,34)(H,30,35)InChIKey
ULZACVQUGLVDGN-UHFFFAOYSA-NSynonyms
443635-42-54(tertbutyl)N(4(4methyl5((2oxo2(phenylamino)ethyl)thio)4H124triazol3yl)phenyl)benzamide
443635425
4tertbutylN(4(4methyl5((2oxo2(phenylamino)ethyl)sulfanyl)4H124triazol3yl)phenyl)benzamide
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NN=C(N3C)SCC(=O)NC4=CC=CC=C4
InChI=1SC28H29N5O2Sc128(23)21141020(111521)26(35)3023161219(131723)25313227(33(25)4)361824(34)29228657922h517H18H214H3(H2934)(H3035)
MFCD02951535
N(4(5((2ANILINO2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)4TERTBUTYLBENZAMIDE
N(4(5(2ANILINO2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)PHENYL)4TERTBUTYLBENZAMIDE
ZINC000000680508
ZINC00680508
ZINC680508
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