Vitas-M small molecule compound
N-(3-methoxyphenyl)-Nalpha-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]-L-tryptophanamide
Catalog ID
STL534512
SMILES COc1cccc(c1)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)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 C28H28N4O3 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O3/c1-35-22-10-6-9-21(15-22)31-28(34)26(14-20-17-29-24-12-5-4-11-23(20)24)32-27(33)25-13-18-7-2-3-8-19(18)16-30-25/h2-12,15,17,25-26,29-30H,13-14,16H2,1H3,(H,31,34)(H,32,33)/t25-,26-/m0/s1InChIKey
BIUZXRRWYROHHD-UIOOFZCWSA-NSynonyms
(3~(S))~(N)((2~(S))3(1~(H)indol3yl)1(3methoxyanilino)1oxopropan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((S)3(1Hindol3yl)1((3methoxyphenyl)amino)1oxopropan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
16404670
COc1cccc(c1)NC(=O)(C@H)(Cc1c(nH)c2c1cccc2)NC(=O)(C@H)1NCc2c(C1)cccc2Cl
InChI=1SC28H28N4O3c13522106921(1522)3128(34)26(142017292412541123(20)24)3227(33)251318723819(18)163025h212151725262930H131416H21H3(H3134)(H3233)t2526m0s1
N(3methoxyphenyl)Nalpha((3S)1234tetrahydroisoquinolin3ylcarbonyl)Ltryptophanamide
ZINC000035485299
ZINC35485299
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