Vitas-M small molecule compound
3-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-yl)-4-methylbenzamide
Catalog ID
STK825925
SMILES O=C(c1ccc(c(c1)S(=O)(=O)N1CCCCCC1)C)Nc1ccc2c(c1)OCO2
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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 C21H24N2O5S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5S/c1-15-6-7-16(12-20(15)29(25,26)23-10-4-2-3-5-11-23)21(24)22-17-8-9-18-19(13-17)28-14-27-18/h6-9,12-13H,2-5,10-11,14H2,1H3,(H,22,24)InChIKey
PNIJAJDOIIBTCP-UHFFFAOYSA-NSynonyms
690247-22-43(azepan1ylsulfonyl)N(13benzodioxol5yl)4methylbenzamide
3(AZEPAN1YLSULFONYL)N(BENZO(D)(13)DIOXOL5YL)4METHYLBENZAMIDE
690247224
CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCCC4
InChI=1SC21H24N2O5Sc1156716(1220(15)29(2526)231042351123)21(24)2217891819(1317)28142718h691213H25101114H21H3(H2224)
MFCD04445557
N(2HBENZO(34D)13DIOXOLAN5YL)(3(AZAPERHYDROEPINYLSULFONYL)4METHYLPHENYL)CARBOXAMIDE
ZINC000001058172
ZINC01058172
ZINC1058172
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