Vitas-M small molecule compound
tert-butyl (3S)-3-({(2R)-1-[(2,4-dimethylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK574573
SMILES Cc1ccc(c(c1)C)NC(=O)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(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 C26H33N3O4 MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O4/c1-16-11-12-21(17(2)13-16)28-23(30)18(3)27-24(31)22-14-19-9-7-8-10-20(19)15-29(22)25(32)33-26(4,5)6/h7-13,18,22H,14-15H2,1-6H3,(H,27,31)(H,28,30)/t18-,22+/m1/s1InChIKey
FDXBSOLWAXWZOB-GCJKJVERSA-NSynonyms
1014023-01-8(S)tertbutyl3(((S)1((24dimethylphenyl)amino)1oxopropan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1014023018
CC1=CC(=C(C=C1)NC(=O)C(C)NC(=O)C2CC3=CC=CC=C3CN2C(=O)OC(C)(C)C)C
Cc1ccc(c(c1)C)NC(=O)(C@@H)(NC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)C
Cc1ccc(c(c1)C)NC(=O)(C@H)(NC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)C
InChI=1SC26H33N3O4c116111221(17(2)1316)2823(30)18(3)2724(31)2214199781020(19)1529(22)25(32)3326(45)6h7131822H1415H216H3(H2731)(H2830)t1822+m1s1
MFCD06779249
tertbutyl(3S)3(((2R)1((24dimethylphenyl)amino)1oxopropan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
tertbutyl(3S)3(((2R)1(24dimethylanilino)1oxopropan2yl)carbamoyl)34dihydro1Hisoquinoline2carboxylate
ZINC000009488335
ZINC09488335
ZINC9488335
Check stock
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Check stock on Vitas-MAvailable files
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