Vitas-M small molecule compound

3-[3-(1H-indol-3-yl)propanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STL475435
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)CCc1c[nH]c2c1cccc2

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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 C22H23N3O2 MW 361.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O2/c26-21(9-8-16-11-23-19-5-2-1-4-18(16)19)24-12-15-10-17(14-24)20-6-3-7-22(27)25(20)13-15/h1-7,11,15,17,23H,8-10,12-14H2
InChIKey
SQZZFXSQRYPRGT-UHFFFAOYSA-N
Synonyms

(1R5S)3(3(1Hindol3yl)propanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3(3(1Hindol3yl)propanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)CCC4=CNC5=CC=CC=C54
InChI=1SC22H23N3O2c2621(9816112319521418(16)19)2412151017(1424)2063722(27)25(20)1315h1711151723H8101214H2
MFCD31751281
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)CCc1c(nH)c2c1cccc2
O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)CCc1c(nH)c2c1cccc2
ZINC000096116058

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Available files

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