Vitas-M small molecule compound
(1S,5R)-3-[(4-oxoquinazolin-3(4H)-yl)acetyl]-1,2,3,4,5,6-hexahydro-10H-1,5-methanopyrido[1,2-d][1,4]diazocin-10-one
Catalog ID
STL535207
SMILES O=C(N1C[C@@H]2C[C@H](C1)n1c(C2)cccc1=O)Cn1cnc2c(c1=O)cccc2
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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 C21H20N4O3 MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3/c26-19-7-3-4-15-8-14-9-16(25(15)19)11-23(10-14)20(27)12-24-13-22-18-6-2-1-5-17(18)21(24)28/h1-7,13-14,16H,8-12H2/t14-,16+/m1/s1InChIKey
KYBUFSNCAQUFFD-ZBFHGGJFSA-NSynonyms
(1S5R)3((4oxoquinazolin3(4H)yl)acetyl)123456hexahydro10H15methanopyrido(12d)(14)diazocin10one
(1S5S)3(2(4oxoquinazolin3(4H)yl)acetyl)3456tetrahydro1H15methanopyrido(12d)(14)diazocin10(2H)one
InChI=1SC21H20N4O3c261973415814916(25(15)19)1123(1014)20(27)1224132218621517(18)21(24)28h17131416H812H2t1416+m1s1
MFCD08743168
O=C(N1C(C@@H)2C(C@@H)(C1)n1c(C2)cccc1=O)Cn1cnc2c(c1=O)cccc2
ZINC000100788539
Check stock
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