Vitas-M small molecule compound
N-[4,5-dimethyl-3-(phenylsulfonyl)-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK719444
SMILES C=CCn1c(C)c(c(c1NC(=O)c1ccc2c(c1)OCO2)S(=O)(=O)c1ccccc1)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 C23H22N2O5S MW 438.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O5S/c1-4-12-25-16(3)15(2)21(31(27,28)18-8-6-5-7-9-18)22(25)24-23(26)17-10-11-19-20(13-17)30-14-29-19/h4-11,13H,1,12,14H2,2-3H3,(H,24,26)InChIKey
FRYIWOAEXUZBEW-UHFFFAOYSA-NSynonyms
1010916-94-51010916945
CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4)CC=C)C
InChI=1SC23H22N2O5Sc14122516(3)15(2)21(31(2728)188657918)22(25)2423(26)1710111920(1317)30142919h41113H11214H223H3(H2426)
MFCD12204118
N(1allyl45dimethyl3(phenylsulfonyl)1Hpyrrol2yl)benzo(d)(13)dioxole5carboxamide
N(3(benzenesulfonyl)45dimethyl1prop2enylpyrrol2yl)13benzodioxole5carboxamide
N(45dimethyl3(phenylsulfonyl)1(prop2en1yl)1Hpyrrol2yl)13benzodioxole5carboxamide
ZINC000012408459
ZINC12408459
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