Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-chloro-2-methylphenyl)acetamide
Catalog ID
STL299215
SMILES O=C(Nc1cccc(c1C)Cl)CSc1nnc(n1c1ccc(cc1)C)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 C28H29ClN4OS MW 505.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClN4OS/c1-18-9-15-22(16-10-18)33-26(20-11-13-21(14-12-20)28(3,4)5)31-32-27(33)35-17-25(34)30-24-8-6-7-23(29)19(24)2/h6-16H,17H2,1-5H3,(H,30,34)InChIKey
XQHIDUVBMPFGRG-UHFFFAOYSA-NSynonyms
861118-91-42((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(3chloro2methylphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(3CHLORO2METHYLPHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(3chloro2methylphenyl)acetamide
2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))N(3CHLORO2METHYLPHENYL)ACETAMIDE
861118914
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C(=CC=C3)Cl)C)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC28H29ClN4OSc11891522(161018)3326(20111321(141220)28(34)5)313227(33)351725(34)302486723(29)19(24)2h616H17H215H3(H3034)
MFCD05683187
ZINC000009307638
ZINC09307638
ZINC9307638
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