Vitas-M small molecule compound
tert-butyl (3S)-3-[(4-methylbenzyl)carbamoyl]-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK572873
SMILES O=C([C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)NCc1ccc(cc1)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 C23H28N2O3 MW 380.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O3/c1-16-9-11-17(12-10-16)14-24-21(26)20-13-18-7-5-6-8-19(18)15-25(20)22(27)28-23(2,3)4/h5-12,20H,13-15H2,1-4H3,(H,24,26)/t20-/m0/s1InChIKey
RJQCATAJEQJNIE-FQEVSTJZSA-NSynonyms
1173675-85-8(S)tertbutyl3((4methylbenzyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1173675858
CC1=CC=C(C=C1)CNC(=O)C2CC3=CC=CC=C3CN2C(=O)OC(C)(C)C
InChI=1SC23H28N2O3c11691117(121016)142421(26)201318756819(18)1525(20)22(27)2823(23)4h51220H1315H214H3(H2426)t20m0s1
MFCD06790395
O=C((C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)NCc1ccc(cc1)C
tertbutyl(3S)3((4methylbenzyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
TERTBUTYL(3S)3((4METHYLPHENYL)METHYLCARBAMOYL)34DIHYDRO1HISOQUINOLINE2CARBOXYLATE
ZINC000005347767
ZINC05347767
ZINC5347767
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