Vitas-M small molecule compound
3-({4-[4-(phenylamino)phthalazin-1-yl]phenyl}carbonyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL237473
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)c1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccccc1
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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 C32H27N5O2 MW 513.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27N5O2/c38-29-12-6-11-28-24-17-21(19-37(28)29)18-36(20-24)32(39)23-15-13-22(14-16-23)30-26-9-4-5-10-27(26)31(35-34-30)33-25-7-2-1-3-8-25/h1-16,21,24H,17-20H2,(H,33,35)InChIKey
PMNYZUYEGZRLDL-UHFFFAOYSA-NSynonyms
(1R5S)3(4(4(phenylamino)phthalazin1yl)benzoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3((4(4(phenylamino)phthalazin1yl)phenyl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)C4=CC=C(C=C4)C5=NN=C(C6=CC=CC=C65)NC7=CC=CC=C7
InChI=1SC32H27N5O2c38291261128241721(1937(28)29)1836(2024)32(39)23151322(141623)30269451027(26)31(353430)33257213825h1162124H1720H2(H3335)
MFCD02999505
O=C(N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)c1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccccc1
ZINC000009009982
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