Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-({5-[(2-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)propanamide
Catalog ID
STK230665
SMILES C=CCn1c(nnc1COc1ccccc1C)SC(C(=O)Nc1ccc2c(c1)OCO2)C
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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 C23H24N4O4S MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O4S/c1-4-11-27-21(13-29-18-8-6-5-7-15(18)2)25-26-23(27)32-16(3)22(28)24-17-9-10-19-20(12-17)31-14-30-19/h4-10,12,16H,1,11,13-14H2,2-3H3,(H,24,28)InChIKey
SXQVOGGSYRJOHW-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1OCC2=NN=C(N2CC=C)SC(C)C(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC23H24N4O4Sc14112721(132918865715(18)2)252623(27)3216(3)22(28)24179101920(1217)31143019h4101216H1111314H223H3(H2428)
MFCD07790752
N(13benzodioxol5yl)2((5((2methylphenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)propanamide
N(13BENZODIOXOL5YL)2((5((2METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)PROPANAMIDE
ZINC000009289838
ZINC000009289839
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