Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(2-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK696995
SMILES C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1c1ccccc1C
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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 C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-3-10-26-21(17-7-5-4-6-15(17)2)24-25-22(26)30-14-20(27)23-16-8-9-18-19(13-16)29-12-11-28-18/h3-9,13H,1,10-12,14H2,2H3,(H,23,27)InChIKey
UAHMBUMRPMJKDS-UHFFFAOYSA-NSynonyms
899396-05-52((4allyl5(otolyl)4H124triazol3yl)thio)N(23dihydrobenzo(b)(14)dioxin6yl)acetamide
899396055
CC1=CC=CC=C1C2=NN=C(N2CC=C)SCC(=O)NC3=CC4=C(C=C3)OCCO4
InChI=1SC22H22N4O3Sc13102621(17754615(17)2)242522(26)301420(27)2316891819(1316)2912112818h3913H1101214H22H3(H2327)
MFCD06605173
N(23dihydro14benzodioxin6yl)2((5(2methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(23DIHYDRO14BENZODIOXIN6YL)2((5(2METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2H3HBENZO(34E)14DIOXIN6YL)2(5(2METHYLPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002323753
ZINC02323753
ZINC2323753
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