Vitas-M small molecule compound

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

Catalog ID
STK579253
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

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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 C24H22N4O3S2 MW 478.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3S2/c1-16-4-7-18(8-5-16)28-22(14-19-3-2-12-32-19)26-27-24(28)33-15-23(29)25-17-6-9-20-21(13-17)31-11-10-30-20/h2-9,12-13H,10-11,14-15H2,1H3,(H,25,29)
InChIKey
VQHPVKHFAPRCHJ-UHFFFAOYSA-N
Synonyms
896855-54-2
896855542
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)OCCO4)CC5=CC=CS5
InChI=1SC24H22N4O3S2c1164718(8516)2822(141932123219)262724(28)331523(29)2517692021(1317)3111103020h291213H10111415H21H3(H2529)
MFCD06603943
N(23DIHYDRO14BENZODIOXIN6YL)2((4(4METHYLPHENYL)5(THIOPHEN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(23dihydro14benzodioxin6yl)2((4(4methylphenyl)5(thiophen2ylmethyl)4H124triazol3yl)sulfanyl)acetamide
N(23dihydrobenzo(b)(14)dioxin6yl)2((5(thiophen2ylmethyl)4(ptolyl)4H124triazol3yl)thio)acetamide
N(2H3HBENZO(34E)14DIOXIN6YL)2(4(4METHYLPHENYL)5(2THIENYLMETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002241458
ZINC02241458
ZINC2241458

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Available files

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