Vitas-M small molecule compound
N-[1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-(1,3-benzodioxol-5-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Catalog ID
STL407643
SMILES CN1C(c2ccc3c(c2)OCO3)C(C(=O)NC(c2nc3c([nH]2)cccc3)C(C)C)c2c(C1=O)cccc2
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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 C29H28N4O4 MW 496.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O4/c1-16(2)25(27-30-20-10-6-7-11-21(20)31-27)32-28(34)24-18-8-4-5-9-19(18)29(35)33(3)26(24)17-12-13-22-23(14-17)37-15-36-22/h4-14,16,24-26H,15H2,1-3H3,(H,30,31)(H,32,34)InChIKey
RFYPSXFBQYRTFS-UHFFFAOYSA-NSynonyms
CC(C)C(C1=NC2=CC=CC=C2N1)NC(=O)C3C(N(C(=O)C4=CC=CC=C34)C)C5=CC6=C(C=C5)OCO6
CN1C(c2ccc3c(c2)OCO3)C(C(=O)N(C@H)(c2nc3c((nH)2)cccc3)C(C)C)c2c(C1=O)cccc2
CN1C(c2ccc3c(c2)OCO3)C(C(=O)NC(c2nc3c((nH)2)cccc3)C(C)C)c2c(C1=O)cccc2
InChI=1SC29H28N4O4c116(2)25(27302010671121(20)3127)3228(34)2418845919(18)29(35)33(3)26(24)1712132223(1417)37153622h414162426H15H213H3(H3031)(H3234)
MFCD30704842
N((S)1(1Hbenzo(d)imidazol2yl)2methylpropyl)3(benzo(d)(13)dioxol5yl)2methyl1oxo1234tetrahydroisoquinoline4carboxamide
N(1(1Hbenzimidazol2yl)2methylpropyl)3(13benzodioxol5yl)2methyl1oxo1234tetrahydroisoquinoline4carboxamide
N(1(1Hbenzimidazol2yl)2methylpropyl)3(13benzodioxol5yl)2methyl1oxo34dihydroisoquinoline4carboxamide
ZINC000096232251
ZINC000096232254
Check stock
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Check stock on Vitas-MAvailable files
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