Vitas-M small molecule compound

N-(3-chloro-4-methoxyphenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Catalog ID
STK576231
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)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 C22H23ClN4O3S MW 458.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN4O3S/c1-4-11-27-20(13-30-17-8-5-15(2)6-9-17)25-26-22(27)31-14-21(28)24-16-7-10-19(29-3)18(23)12-16/h4-10,12H,1,11,13-14H2,2-3H3,(H,24,28)
InChIKey
XLKCCVBQCBOAON-UHFFFAOYSA-N
Synonyms
849026-04-6
2((4allyl5((ptolyloxy)methyl)4H124triazol3yl)thio)N(3chloro4methoxyphenyl)acetamide
849026046
CC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC(=O)NC3=CC(=C(C=C3)OC)Cl
InChI=1SC22H23ClN4O3Sc14112720(1330178515(2)6917)252622(27)311421(28)241671019(293)18(23)1216h41012H1111314H223H3(H2428)
MFCD05681366
N(3chloro4methoxyphenyl)2((5((4methylphenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(3CHLORO4METHOXYPHENYL)2((5((4METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3CHLORO4METHOXYPHENYL)2((5(4METHYLPHENOXYMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3CHLORO4METHOXYPHENYL)2(5((4METHYLPHENOXY)METHYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002453370
ZINC02453370
ZINC2453370

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Available files

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