Vitas-M small molecule compound
(3S)-N-{(2S)-1-[(3-methoxyphenyl)amino]-3-methyl-1-oxobutan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Catalog ID
STK601129
SMILES COc1cccc(c1)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 C22H27N3O3 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O3/c1-14(2)20(22(27)24-17-9-6-10-18(12-17)28-3)25-21(26)19-11-15-7-4-5-8-16(15)13-23-19/h4-10,12,14,19-20,23H,11,13H2,1-3H3,(H,24,27)(H,25,26)/t19-,20-/m0/s1InChIKey
HNBIJYCBDOVXKZ-PMACEKPBSA-NSynonyms
(3S)N((2S)1((3methoxyphenyl)amino)3methyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamide
(3S)N((2S)1(3methoxyanilino)3methyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((S)1((3methoxyphenyl)amino)3methyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
CC(C)C(C(=O)NC1=CC(=CC=C1)OC)NC(=O)C2CC3=CC=CC=C3CN2
COc1cccc(c1)NC(=O)(C@H)(C(C)C)NC(=O)(C@H)1NCc2c(C1)cccc2
COc1cccc(c1)NC(=O)(C@H)(C(C)C)NC(=O)(C@H)1NCc2c(C1)cccc2Cl
InChI=1SC22H27N3O3c114(2)20(22(27)2417961018(1217)283)2521(26)191115745816(15)132319h4101214192023H1113H213H3(H2427)(H2526)t1920m0s1
MFCD06780841
ZINC000035485479
ZINC35485479
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