Vitas-M small molecule compound

2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide

Catalog ID
STK593747
SMILES Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nnc1COc1ccc(cc1)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 C29H26N4O2S MW 494.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O2S/c1-20-10-14-23(15-11-20)33-27(18-35-24-16-12-21(2)13-17-24)31-32-29(33)36-19-28(34)30-26-9-5-7-22-6-3-4-8-25(22)26/h3-17H,18-19H2,1-2H3,(H,30,34)
InChIKey
CUHZSIWBSNOHAJ-UHFFFAOYSA-N
Synonyms
896857-40-2
2((5((4METHYLPHENOXY)METHYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)NNAPHTHALEN1YLACETAMIDE
2((5((4methylphenoxy)methyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(naphthalen1yl)acetamide
2((5(4METHYLPHENOXYMETHYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N(NAPHTHALEN1YL)ACETAMIDE
2(4(4METHYLPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))NNAPHTHYLACETAMIDE
896857402
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC4=CC=CC=C43)COC5=CC=C(C=C5)C
InChI=1SC29H26N4O2Sc120101423(151120)3327(183524161221(2)131724)313229(33)361928(34)302695722634825(22)26h317H1819H212H3(H3034)
MFCD06604200
N(naphthalen1yl)2((4(ptolyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
ZINC000002241968
ZINC02241968
ZINC2241968

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.