Vitas-M small molecule compound
(1S,5R)-3-{[(3Z)-6-chloro-3-(4-methoxybenzylidene)-2-oxo-2,3-dihydro-1H-indol-1-yl]methyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL010101
SMILES COc1ccc(cc1)/C=C\1/c2ccc(cc2N(C1=O)CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cl
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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 C28H26ClN3O3 MW 487.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN3O3/c1-35-22-8-5-18(6-9-22)12-24-23-10-7-21(29)13-26(23)32(28(24)34)17-30-14-19-11-20(16-30)25-3-2-4-27(33)31(25)15-19/h2-10,12-13,19-20H,11,14-17H2,1H3/b24-12-/t19-,20+/m0/s1InChIKey
HSJDLDYUULZXCD-DRPPQUAKSA-NSynonyms
1005262-87-2(1R5S)3(((Z)6chloro3(4methoxybenzylidene)2oxoindolin1yl)methyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(((3Z)6chloro3(4methoxybenzylidene)2oxo23dihydro1Hindol1yl)methyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
1005262872
COC1=CC=C(C=C1)C=C2C3=C(C=C(C=C3)Cl)N(C2=O)CN4CC5CC(C4)C6=CC=CC(=O)N6C5
COc1ccc(cc1)C=C1c2ccc(cc2N(C1=O)CN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)Cl
InChI=1SC28H26ClN3O3c135228518(6922)12242310721(29)1326(23)32(28(24)34)173014191120(1630)2532427(33)31(25)1519h21012131920H111417H21H3b2412t1920+m1s1
MFCD10487951
ZINC000008764860
ZINC08764860
ZINC8764860
Check stock
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Check stock on Vitas-MAvailable files
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