Vitas-M small molecule compound
3-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]carbonyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STK948413
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-]
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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 C22H18ClN3O5 MW 439.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O5/c23-17-9-15(26(29)30)4-5-16(17)19-6-7-20(31-19)22(28)24-10-13-8-14(12-24)18-2-1-3-21(27)25(18)11-13/h1-7,9,13-14H,8,10-12H2InChIKey
IEYIAQKUFZAYBP-UHFFFAOYSA-NSynonyms
(1R5S)3(5(2chloro4nitrophenyl)furan2carbonyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3((5(2chloro4nitrophenyl)furan2yl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)C4=CC=C(O4)C5=C(C=C(C=C5)(N+)(=O)(O))Cl
InChI=1SC22H18ClN3O5c2317915(26(29)30)4516(17)196720(3119)22(28)241013814(1224)1821321(27)25(18)1113h1791314H81012H2
MFCD10044524
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)c1ccc(o1)c1ccc(cc1Cl)(N+)(=O)(O)
O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)c1ccc(o1)c1ccc(cc1Cl)(N+)(=O)(O)
ZINC000008791407
Check stock
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