Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK585804
SMILES Clc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)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 C25H21ClN4O4S MW 508.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN4O4S/c1-16-2-9-20(10-3-16)32-13-23-28-29-25(30(23)19-7-4-17(26)5-8-19)35-14-24(31)27-18-6-11-21-22(12-18)34-15-33-21/h2-12H,13-15H2,1H3,(H,27,31)InChIKey
SKMKQPQRLNROTF-UHFFFAOYSA-NSynonyms
896822-42-7896822427
CC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC5=C(C=C4)OCO5
InChI=1SC25H21ClN4O4Sc1162920(10316)321323282925(30(23)197417(26)5819)351424(31)27186112122(1218)34153321h212H1315H21H3(H2731)
MFCD06598151
N(13BENZODIOXOL5YL)2((4(4CHLOROPHENYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13benzodioxol5yl)2((4(4chlorophenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)acetamide
N(2H13BENZODIOXOL5YL)2((4(4CHLOROPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2HBENZO(34D)13DIOXOLEN5YL)2(4(4CHLOROPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(benzo(d)(13)dioxol5yl)2((4(4chlorophenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
ZINC000002213381
ZINC02213381
ZINC2213381
Check stock
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Check stock on Vitas-MAvailable files
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