Vitas-M small molecule compound
(4E)-4-[(acetyloxy)imino]-2,3,4,7,8,9,10,11-octahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepin-13(1H)-one
Catalog ID
STK280008
SMILES CC(=O)O/N=C/1\CCCc2c1sc1c2c(=O)n2c(n1)CCCCC2
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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 C17H19N3O3S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O3S/c1-10(21)23-19-12-7-5-6-11-14-16(24-15(11)12)18-13-8-3-2-4-9-20(13)17(14)22/h2-9H2,1H3/b19-12+InChIKey
XAWQKDDKFVQVNZ-XDHOZWIPSA-NSynonyms
(4E)4((acetyloxy)imino)2347891011octahydro(1)benzothieno(2345)pyrimido(12a)azepin13(1H)one
CC(=O)ON=C1CCCC2=C1SC3=C2C(=O)N4CCCCCC4=N3
CC(=O)ON=C1CCCc2c1sc1c2c(=O)n2c(n1)CCCCC2
InChI=1SC17H19N3O3Sc110(21)231912756111416(2415(11)12)18138324920(13)17(14)22h29H21H3b1912+
MFCD00386797
ZINC000000359564
ZINC22203676
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