Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-N-(1H-indol-6-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Catalog ID
STK941856
SMILES O=C(C1c2ccccc2C(=O)N(C1c1ccc2c(c1)OCO2)C)Nc1ccc2c(c1)[nH]cc2
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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 C26H21N3O4 MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O4/c1-29-24(16-7-9-21-22(12-16)33-14-32-21)23(18-4-2-3-5-19(18)26(29)31)25(30)28-17-8-6-15-10-11-27-20(15)13-17/h2-13,23-24,27H,14H2,1H3,(H,28,30)InChIKey
KMMDHNKBYBKIIV-UHFFFAOYSA-NSynonyms
1219575-97-91219575979
3(13benzodioxol5yl)N(1Hindol6yl)2methyl1oxo1234tetrahydroisoquinoline4carboxamide
3(13benzodioxol5yl)N(1Hindol6yl)2methyl1oxo34dihydroisoquinoline4carboxamide
3(benzo(d)(13)dioxol5yl)N(1Hindol6yl)2methyl1oxo1234tetrahydroisoquinoline4carboxamide
CN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC4=C(C=C3)C=CN4)C5=CC6=C(C=C5)OCO6
InChI=1SC26H21N3O4c12924(16792122(1216)33143221)23(18423519(18)26(29)31)25(30)2817861510112720(15)1317h213232427H14H21H3(H2830)
MFCD16625361
O=C(C1c2ccccc2C(=O)N(C1c1ccc2c(c1)OCO2)C)Nc1ccc2c(c1)(nH)cc2
ZINC000040284133
ZINC000040284139
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