Vitas-M small molecule compound

(8S,8aR,11aS,11bS)-10-(4-methylphenyl)-9,11-dioxo-N-phenyl-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide

Catalog ID
STK555317
SMILES Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)Nc2ccccc2)C=Cc2c1cccc2

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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 C28H23N3O3 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O3/c1-17-11-13-20(14-12-17)31-27(33)22-23(28(31)34)25(26(32)29-19-8-3-2-4-9-19)30-16-15-18-7-5-6-10-21(18)24(22)30/h2-16,22-25H,1H3,(H,29,32)/t22-,23+,24+,25-/m0/s1
InChIKey
CIGDVKXVINJUGT-LIONHTAISA-N
Synonyms
1013823-49-8
(8S8aR11aS11bS)10(4methylphenyl)911dioxoNphenyl8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
(8S8aR11aS11bS)911dioxoNphenyl10(ptolyl)8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
1013823498
CC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)NC6=CC=CC=C6
Cc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)1N((C@@H)2C(=O)Nc2ccccc2)C=Cc2c1cccc2
InChI=1SC28H23N3O3c117111320(141217)3127(33)2223(28(31)34)25(26(32)29198324919)301615187561021(18)24(22)30h2162225H1H3(H2932)t2223+24+25m0s1
MFCD18242855
ZINC000015974693
ZINC15974693

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Available files

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