Vitas-M small molecule compound

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

Catalog ID
STK545548
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

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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 C23H18ClN5O3S MW 479.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN5O3S/c24-16-1-4-18(5-2-16)29-22(15-7-9-25-10-8-15)27-28-23(29)33-14-21(30)26-17-3-6-19-20(13-17)32-12-11-31-19/h1-10,13H,11-12,14H2,(H,26,30)
InChIKey
HZQPSBITVGVBMI-UHFFFAOYSA-N
Synonyms
613225-84-6
2((4(4chlorophenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2((4(4chlorophenyl)5(pyridin4yl)4H124triazol3yl)thio)N(23dihydrobenzo(b)(14)dioxin6yl)acetamide
2((4(4CHLOROPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(23DIHYDRO14BENZODIOXIN6YL)ACETAMIDE
613225846
C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)C5=CC=NC=C5
InChI=1SC23H18ClN5O3Sc24161418(5216)2922(15792510815)272823(29)331421(30)2617361920(1317)3212113119h11013H111214H2(H2630)
MFCD03222804
N(2H3HBENZO(34E)14DIOXIN6YL)2(4(4CHLOROPHENYL)5(4PYRIDYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001240545
ZINC01240545
ZINC1240545

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Available files

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