Vitas-M small molecule compound
N-1,3-benzodioxol-5-yl-Nalpha-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]-L-tryptophanamide
Catalog ID
STL533994
SMILES O=C([C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H]1NCc2c(C1)cccc2)Nc1ccc2c(c1)OCO2
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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 C28H26N4O4 MW 482.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O4/c33-27(23-11-17-5-1-2-6-18(17)14-30-23)32-24(12-19-15-29-22-8-4-3-7-21(19)22)28(34)31-20-9-10-25-26(13-20)36-16-35-25/h1-10,13,15,23-24,29-30H,11-12,14,16H2,(H,31,34)(H,32,33)/t23-,24-/m0/s1InChIKey
QSZPQBZNMUEBQE-ZEQRLZLVSA-NSynonyms
(3~(S))~(N)((2~(S))1(13benzodioxol5ylamino)3(1~(H)indol3yl)1oxopropan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((S)1(benzo(d)(13)dioxol5ylamino)3(1Hindol3yl)1oxopropan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
16404386
InChI=1SC28H26N4O4c3327(231117512618(17)143023)3224(1219152922843721(19)22)28(34)31209102526(1320)36163525h110131523242930H11121416H2(H3134)(H3233)t2324m0s1
N13benzodioxol5ylNalpha((3S)1234tetrahydroisoquinolin3ylcarbonyl)Ltryptophanamide
O=C((C@H)(Cc1c(nH)c2c1cccc2)NC(=O)(C@H)1NCc2c(C1)cccc2)Nc1ccc2c(c1)OCO2Cl
ZINC000035485307
ZINC35485307
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