Vitas-M small molecule compound

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

Catalog ID
STK574538
SMILES CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)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 C29H32N4O2S MW 500.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O2S/c1-5-22(4)23-10-12-24(13-11-23)30-28(34)19-36-29-32-31-27(18-35-26-16-8-21(3)9-17-26)33(29)25-14-6-20(2)7-15-25/h6-17,22H,5,18-19H2,1-4H3,(H,30,34)
InChIKey
CUMWZCPBAPJTOT-UHFFFAOYSA-N
Synonyms
899403-29-3
2(4(4METHYLPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))N(4(METHYLPROPYL)PHENYL)ACETAMIDE
899403293
CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)C)COC4=CC=C(C=C4)C
InChI=1SC29H32N4O2Sc1522(4)23101224(131123)3028(34)193629323127(18352616821(3)91726)33(29)2514620(2)71525h61722H51819H214H3(H3034)
MFCD06606836
N(4(butan2yl)phenyl)2((5((4methylphenoxy)methyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)acetamide
N(4(BUTAN2YL)PHENYL)2((5(4METHYLPHENOXYMETHYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4(secbutyl)phenyl)2((4(ptolyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
N(4BUTAN2YLPHENYL)2((5((4METHYLPHENOXY)METHYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002330558
ZINC000002330561

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Available files

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