Vitas-M small molecule compound

tert-butyl (3S)-3-[(3,4-dimethoxybenzyl)carbamoyl]-3,4-dihydroisoquinoline-2(1H)-carboxylate

Catalog ID
STK584939
SMILES COc1cc(CNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)ccc1OC

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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 C24H30N2O5 MW 426.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O5/c1-24(2,3)31-23(28)26-15-18-9-7-6-8-17(18)13-19(26)22(27)25-14-16-10-11-20(29-4)21(12-16)30-5/h6-12,19H,13-15H2,1-5H3,(H,25,27)/t19-/m0/s1
InChIKey
MUTGHSYPUABQSU-IBGZPJMESA-N
Synonyms
1173682-30-8
(S)tertbutyl3((34dimethoxybenzyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1173682308
CC(C)(C)OC(=O)N1CC2=CC=CC=C2CC1C(=O)NCC3=CC(=C(C=C3)OC)OC
COc1cc(CNC(=O)(C@@H)2Cc3ccccc3CN2C(=O)OC(C)(C)C)ccc1OC
InChI=1SC24H30N2O5c124(23)3123(28)261518976817(18)1319(26)22(27)251416101120(294)21(1216)305h61219H1315H215H3(H2527)t19m0s1
MFCD06774815
tertbutyl(3S)3((34dimethoxybenzyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
tertbutyl(3S)3((34dimethoxyphenyl)methylcarbamoyl)34dihydro1Hisoquinoline2carboxylate
ZINC000005246192
ZINC05246192
ZINC5246192

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Available files

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