Vitas-M small molecule compound
1-amino-N-(1,3-benzodioxol-5-yl)-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Catalog ID
STK788833
SMILES CCc1nc2sc(c(c2c2c1CCCC2)N)C(=O)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 C21H21N3O3S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S/c1-2-14-12-5-3-4-6-13(12)17-18(22)19(28-21(17)24-14)20(25)23-11-7-8-15-16(9-11)27-10-26-15/h7-9H,2-6,10,22H2,1H3,(H,23,25)InChIKey
HXWFLPPYEXDKFW-UHFFFAOYSA-NSynonyms
712295-97-11aminoN(13benzodioxol5yl)5ethyl6789tetrahydrothieno(23c)isoquinoline2carboxamide
1aminoN(benzo(d)(13)dioxol5yl)5ethyl6789tetrahydrothieno(23c)isoquinoline2carboxamide
712295971
CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)NC4=CC5=C(C=C4)OCO5)N
InChI=1SC21H21N3O3Sc121412534613(12)1718(22)19(2821(17)2414)20(25)2311781516(911)27102615h79H261022H21H3(H2325)
MFCD03685894
ZINC000002247443
ZINC02247443
ZINC2247443
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