Vitas-M small molecule compound
(3S)-N-{(2S)-1-[(2,4-dimethylphenyl)amino]-1-oxo-3-phenylpropan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Catalog ID
STK605550
SMILES Cc1ccc(c(c1)C)NC(=O)[C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)Cc1ccccc1
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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 C27H29N3O2 MW 427.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2/c1-18-12-13-23(19(2)14-18)29-27(32)25(15-20-8-4-3-5-9-20)30-26(31)24-16-21-10-6-7-11-22(21)17-28-24/h3-14,24-25,28H,15-17H2,1-2H3,(H,29,32)(H,30,31)/t24-,25-/m0/s1InChIKey
LTPSFSITJKQBID-DQEYMECFSA-NSynonyms
(3S)N((2S)1((24dimethylphenyl)amino)1oxo3phenylpropan2yl)1234tetrahydroisoquinoline3carboxamide
(3S)N((2S)1(24dimethylanilino)1oxo3phenylpropan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((S)1((24dimethylphenyl)amino)1oxo3phenylpropan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
CC1=CC(=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3CC4=CC=CC=C4CN3)C
Cc1ccc(c(c1)C)NC(=O)(C@@H)(NC(=O)(C@H)1NCc2c(C1)cccc2)Cc1ccccc1
Cc1ccc(c(c1)C)NC(=O)(C@@H)(NC(=O)(C@H)1NCc2c(C1)cccc2)Cc1ccccc1Cl
InChI=1SC27H29N3O2c118121323(19(2)1418)2927(32)25(15208435920)3026(31)24162110671122(21)172824h314242528H1517H212H3(H2932)(H3031)t2425m0s1
MFCD06777162
ZINC000035485607
ZINC35485607
Check stock
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Check stock on Vitas-MAvailable files
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