Vitas-M small molecule compound
tert-butyl (3S)-3-[(4-methoxyphenyl)carbamoyl]-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK581582
SMILES COc1ccc(cc1)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C
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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 C22H26N2O4 MW 382.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4/c1-22(2,3)28-21(26)24-14-16-8-6-5-7-15(16)13-19(24)20(25)23-17-9-11-18(27-4)12-10-17/h5-12,19H,13-14H2,1-4H3,(H,23,25)/t19-/m0/s1InChIKey
DQJIUDGZACDDNU-IBGZPJMESA-NSynonyms
1173668-27-3(S)tertbutyl3((4methoxyphenyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1173668273
CC(C)(C)OC(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC=C(C=C3)OC
COc1ccc(cc1)NC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C
InChI=1SC22H26N2O4c122(23)2821(26)241416865715(16)1319(24)20(25)231791118(274)121017h51219H1314H214H3(H2325)t19m0s1
MFCD06771826
tertbutyl(3S)3((4methoxyphenyl)carbamoyl)34dihydro1Hisoquinoline2carboxylate
tertbutyl(3S)3((4methoxyphenyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
ZINC000005205475
ZINC05205475
ZINC5205475
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