Vitas-M small molecule compound
ethyl 2-{[(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK737240
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1nn(C)c(=O)c2c1cccc2
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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 C21H21N3O4S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S/c1-3-28-21(27)16-14-10-6-7-11-15(14)29-19(16)22-18(25)17-12-8-4-5-9-13(12)20(26)24(2)23-17/h4-5,8-9H,3,6-7,10-11H2,1-2H3,(H,22,25)InChIKey
MRANDJHBVXTSQP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C
ethyl2(((3methyl4oxo34dihydrophthalazin1yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3methyl4oxophthalazine1carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC21H21N3O4Sc132821(27)161410671115(14)2919(16)2218(25)1712845913(12)20(26)24(2)2317h4589H3671011H212H3(H2225)
MFCD06013308
ZINC000001431681
ZINC01431681
ZINC1431681
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