Vitas-M small molecule compound
tert-butyl (3S)-3-[(2-hydroxy-2-phenylethyl)carbamoyl]-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK593173
SMILES O=C(N1Cc2ccccc2C[C@H]1C(=O)NCC(c1ccccc1)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 C23H28N2O4 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O4/c1-23(2,3)29-22(28)25-15-18-12-8-7-11-17(18)13-19(25)21(27)24-14-20(26)16-9-5-4-6-10-16/h4-12,19-20,26H,13-15H2,1-3H3,(H,24,27)/t19-,20?/m0/s1InChIKey
MRJHPDZFPXHTSQ-XJDOXCRVSA-NSynonyms
1173687-19-8(3S)tertbutyl3((2hydroxy2phenylethyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1173687198
CC(C)(C)OC(=O)N1CC2=CC=CC=C2CC1C(=O)NCC(C3=CC=CC=C3)O
InChI=1SC23H28N2O4c123(23)2922(28)25151812871117(18)1319(25)21(27)241420(26)1695461016h412192026H1315H213H3(H2427)t1920?m0s1
MFCD06782535
O=C(N1Cc2ccccc2C(C@H)1C(=O)NCC(c1ccccc1)O)OC(C)(C)C
tertbutyl(3S)3((2hydroxy2phenylethyl)carbamoyl)34dihydro1Hisoquinoline2carboxylate
tertbutyl(3S)3((2hydroxy2phenylethyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
ZINC000005323932
ZINC000005323935
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