Vitas-M small molecule compound
tert-butyl (3S)-3-({4-[(4-ethylphenyl)carbamoyl]piperidin-1-yl}carbonyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK615822
SMILES CCc1ccc(cc1)NC(=O)C1CCN(CC1)C(=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 C29H37N3O4 MW 491.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37N3O4/c1-5-20-10-12-24(13-11-20)30-26(33)21-14-16-31(17-15-21)27(34)25-18-22-8-6-7-9-23(22)19-32(25)28(35)36-29(2,3)4/h6-13,21,25H,5,14-19H2,1-4H3,(H,30,33)/t25-/m0/s1InChIKey
CWOCAHFSBYSTRS-VWLOTQADSA-NSynonyms
1014001-37-6(S)tertbutyl3(4((4ethylphenyl)carbamoyl)piperidine1carbonyl)34dihydroisoquinoline2(1H)carboxylate
1014001376
CCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3CC4=CC=CC=C4CN3C(=O)OC(C)(C)C
CCc1ccc(cc1)NC(=O)C1CCN(CC1)C(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C
InChI=1SC29H37N3O4c1520101224(131120)3026(33)21141631(171521)27(34)251822867923(22)1932(25)28(35)3629(23)4h6132125H51419H214H3(H3033)t25m0s1
MFCD06774152
tertbutyl(3S)3((4((4ethylphenyl)carbamoyl)piperidin1yl)carbonyl)34dihydroisoquinoline2(1H)carboxylate
tertbutyl(3S)3(4((4ethylphenyl)carbamoyl)piperidine1carbonyl)34dihydro1Hisoquinoline2carboxylate
ZINC000008971887
ZINC08971887
ZINC8971887
Check stock
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Check stock on Vitas-MAvailable files
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