Vitas-M small molecule compound
N-[3-(2,3-dihydro-1,4-benzodioxin-2-yl)-1H-1,2,4-triazol-5-yl]-6-(1H-pyrrol-1-yl)hexanamide
Catalog ID
STL569066
SMILES O=C(Nc1[nH]nc(n1)C1COc2c(O1)cccc2)CCCCCn1cccc1
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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 C20H23N5O3 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O3/c26-18(10-2-1-5-11-25-12-6-7-13-25)21-20-22-19(23-24-20)17-14-27-15-8-3-4-9-16(15)28-17/h3-4,6-9,12-13,17H,1-2,5,10-11,14H2,(H2,21,22,23,24,26)InChIKey
AYDBKDIRLRGMIR-UHFFFAOYSA-NSynonyms
127254484
InChI=1SC20H23N5O3c2618(10215112512671325)21202219(232420)17142715834916(15)2817h3469121317H125101114H2(H22122232426)
MFCD32654076
N(3(23dihydro14benzodioxin2yl)1H124triazol5yl)6(1Hpyrrol1yl)hexanamide
N(5(23dihydro14benzodioxin3yl)1H124triazol3yl)6pyrrol1ylhexanamide
N(5(23dihydrobenzo(b)(14)dioxin2yl)1H124triazol3yl)6(1Hpyrrol1yl)hexanamide
O=C(Nc1n(nH)c(n1)C1COc2c(O1)cccc2)CCCCCn1cccc1
ZINC000604419255
ZINC000604419256
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