Vitas-M small molecule compound
(3S)-N-{(2S)-1-[(4-ethylphenyl)amino]-3-methyl-1-oxobutan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Catalog ID
STK576868
SMILES CCc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)[C@H]1NCc2c(C1)cccc2
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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 C23H29N3O2 MW 379.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O2/c1-4-16-9-11-19(12-10-16)25-23(28)21(15(2)3)26-22(27)20-13-17-7-5-6-8-18(17)14-24-20/h5-12,15,20-21,24H,4,13-14H2,1-3H3,(H,25,28)(H,26,27)/t20-,21-/m0/s1InChIKey
IEZGVGGMPPAGLG-SFTDATJTSA-NSynonyms
(3S)N((2S)1((4ethylphenyl)amino)3methyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamide
(3S)N((2S)1(4ethylanilino)3methyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((S)1((4ethylphenyl)amino)3methyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
CCC1=CC=C(C=C1)NC(=O)C(C(C)C)NC(=O)C2CC3=CC=CC=C3CN2
CCc1ccc(cc1)NC(=O)(C@H)(C(C)C)NC(=O)(C@H)1NCc2c(C1)cccc2
CCc1ccc(cc1)NC(=O)(C@H)(C(C)C)NC(=O)(C@H)1NCc2c(C1)cccc2Cl
InChI=1SC23H29N3O2c141691119(121016)2523(28)21(15(2)3)2622(27)201317756818(17)142420h51215202124H41314H213H3(H2528)(H2627)t2021m0s1
MFCD06774098
ZINC000035349312
ZINC35349312
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