Vitas-M small molecule compound

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

Catalog ID
STL050705
SMILES CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)COc1ccc(cc1)Cl)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 C28H29ClN4O3S MW 537.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClN4O3S/c1-4-19(2)20-5-9-22(10-6-20)30-27(34)18-37-28-32-31-26(17-36-25-13-7-21(29)8-14-25)33(28)23-11-15-24(35-3)16-12-23/h5-16,19H,4,17-18H2,1-3H3,(H,30,34)
InChIKey
AITIFNIPEFKVQY-UHFFFAOYSA-N
Synonyms
861139-89-1
2(5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(4(METHYLPROPYL)PHENYL)ACETAMIDE
861139891
CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)COC4=CC=C(C=C4)Cl
InChI=1SC28H29ClN4O3Sc1419(2)205922(10620)3027(34)183728323126(17362513721(29)81425)33(28)23111524(353)161223h51619H41718H213H3(H3034)
MFCD05683873
N(4(butan2yl)phenyl)2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(4(BUTAN2YL)PHENYL)2((5(4CHLOROPHENOXYMETHYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4(secbutyl)phenyl)2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)thio)acetamide
N(4BUTAN2YLPHENYL)2((5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000097958399
ZINC000097958400

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Available files

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