Vitas-M small molecule compound
(3S)-6,7-dimethoxy-2-{[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Catalog ID
STL548963
SMILES COc1cc2C[C@@H](C(=O)N)N(Cc2cc1OC)C(=O)CC1(CCOCC1)n1cccc1
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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 C23H29N3O5 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O5/c1-29-19-12-16-11-18(22(24)28)26(15-17(16)13-20(19)30-2)21(27)14-23(5-9-31-10-6-23)25-7-3-4-8-25/h3-4,7-8,12-13,18H,5-6,9-11,14-15H2,1-2H3,(H2,24,28)/t18-/m0/s1InChIKey
GMDORJNTVGHPEA-SFHVURJKSA-NSynonyms
(3~(S))67dimethoxy2(2(4pyrrol1yloxan4yl)acetyl)34dihydro1~(H)isoquinoline3carboxamide
(3S)67dimethoxy2((4(1Hpyrrol1yl)tetrahydro2Hpyran4yl)acetyl)1234tetrahydroisoquinoline3carboxamide
(S)2(2(4(1Hpyrrol1yl)tetrahydro2Hpyran4yl)acetyl)67dimethoxy1234tetrahydroisoquinoline3carboxamide
121541751
COc1cc2C(C@@H)(C(=O)N)N(Cc2cc1OC)C(=O)CC1(CCOCC1)n1cccc1
InChI=1SC23H29N3O5c1291912161118(22(24)28)26(1517(16)1320(19)302)21(27)1423(593110623)25734825h3478121318H569111415H212H3(H22428)t18m0s1
ZINC000263585224
ZINC263585224
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