Vitas-M small molecule compound
12-oxo-N-(pentafluorophenyl)-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Catalog ID
STL178857
SMILES O=C(c1ccc2c(c1)nc1n(c2=O)CCCCC1)Nc1c(F)c(F)c(c(c1F)F)F
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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 C20H14F5N3O2 MW 423.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14F5N3O2/c21-13-14(22)16(24)18(17(25)15(13)23)27-19(29)9-5-6-10-11(8-9)26-12-4-2-1-3-7-28(12)20(10)30/h5-6,8H,1-4,7H2,(H,27,29)InChIKey
UUEFULCMHXWULW-UHFFFAOYSA-NSynonyms
938017-30-212oxoN(23456pentafluorophenyl)78910tetrahydro6Hazepino(21b)quinazoline3carboxamide
12oxoN(pentafluorophenyl)67891012hexahydroazepino(21b)quinazoline3carboxamide
938017302
C1CCC2=NC3=C(C=CC(=C3)C(=O)NC4=C(C(=C(C(=C4F)F)F)F)F)C(=O)N2CC1
InChI=1SC20H14F5N3O2c211314(22)16(24)18(17(25)15(13)23)2719(29)9561011(89)26124213728(12)20(10)30h568H147H2(H2729)
MFCD08555560
ZINC000036614175
ZINC36614175
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