Vitas-M small molecule compound
tert-butyl (3S)-3-{[2-oxo-2-(propylamino)ethyl]carbamoyl}-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK591294
SMILES CCCNC(=O)CNC(=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 C20H29N3O4 MW 375.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O4/c1-5-10-21-17(24)12-22-18(25)16-11-14-8-6-7-9-15(14)13-23(16)19(26)27-20(2,3)4/h6-9,16H,5,10-13H2,1-4H3,(H,21,24)(H,22,25)/t16-/m0/s1InChIKey
SITVUUZXYXMKNB-INIZCTEOSA-NSynonyms
1173686-01-5(S)tertbutyl3((2oxo2(propylamino)ethyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1173686015
CCCNC(=O)CNC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C
CCCNC(=O)CNC(=O)C1CC2=CC=CC=C2CN1C(=O)OC(C)(C)C
InChI=1SC20H29N3O4c15102117(24)122218(25)161114867915(14)1323(16)19(26)2720(23)4h6916H51013H214H3(H2124)(H2225)t16m0s1
MFCD06781889
TERTBUTYL(3S)3((2OXO2(PROPYLAMINO)ETHYL)CARBAMOYL)34DIHYDRO1HISOQUINOLINE2CARBOXYLATE
tertbutyl(3S)3((2oxo2(propylamino)ethyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
ZINC000005322989
ZINC05322989
ZINC5322989
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