Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-methoxyphenyl)ethanone
Catalog ID
STK575318
SMILES COc1ccc(cc1)n1c(SCC(=O)c2cccc(c2)OC)nnc1c1ccc(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 C28H29N3O3S MW 487.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O3S/c1-28(2,3)21-11-9-19(10-12-21)26-29-30-27(31(26)22-13-15-23(33-4)16-14-22)35-18-25(32)20-7-6-8-24(17-20)34-5/h6-17H,18H2,1-5H3InChIKey
WVNBSNBABNZZST-UHFFFAOYSA-NSynonyms
579440-57-62((5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)THIO)1(3METHOXYPHENYL)ETHANONE
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1(3METHOXYPHENYL)ETHANONE
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(3METHOXYPHENYL)ETHAN1ONE
2((5(4tertbutylphenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)1(3methoxyphenyl)ethanone
2(5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))1(3METHOXYPHENYL)ETHAN1ONE
579440576
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)C4=CC(=CC=C4)OC
InChI=1SC28H29N3O3Sc128(23)2111919(101221)26293027(31(26)22131523(334)161422)351825(32)2076824(1720)345h617H18H215H3
MFCD03223966
ZINC000002395945
ZINC02395945
ZINC2395945
Check stock
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Check stock on Vitas-MAvailable files
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