Vitas-M small molecule compound

2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

Catalog ID
STK567238
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1c1ccccc1Cl

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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 C26H23ClN4O4S MW 523.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN4O4S/c1-2-33-19-10-8-18(9-11-19)31-25(20-5-3-4-6-21(20)27)29-30-26(31)36-16-24(32)28-17-7-12-22-23(15-17)35-14-13-34-22/h3-12,15H,2,13-14,16H2,1H3,(H,28,32)
InChIKey
KDHRNAVVNURVQN-UHFFFAOYSA-N
Synonyms
849827-60-7
2((5(2CHLOROPHENYL)4(4ETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(23DIHYDRO14BENZODIOXIN6YL)ACETAMIDE
2((5(2chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2((5(2chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)thio)N(23dihydrobenzo(b)(14)dioxin6yl)acetamide
849827607
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5Cl
InChI=1SC26H23ClN4O4Sc12331910818(91119)3125(20534621(20)27)293026(31)361624(32)28177122223(1517)3514133422h31215H2131416H21H3(H2832)
MFCD05331759
N(2H3HBENZO(34E)14DIOXIN6YL)2(5(2CHLOROPHENYL)4(4ETHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009309569
ZINC09309569
ZINC9309569

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Available files

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