Vitas-M small molecule compound
3-(4-nitrophenyl)-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
Catalog ID
STK279986
SMILES O=c1n2CCCCCc2nc2c1c(cs2)c1ccc(cc1)[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 C17H15N3O3S MW 341.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O3S/c21-17-15-13(11-5-7-12(8-6-11)20(22)23)10-24-16(15)18-14-4-2-1-3-9-19(14)17/h5-8,10H,1-4,9H2InChIKey
APNBIGLPAIKUFN-UHFFFAOYSA-NSynonyms
309736-22-93(4nitrophenyl)78910tetrahydro6Hthieno(12)pyrimido(45a)azepin4one
3(4nitrophenyl)78910tetrahydrothieno(2345)pyrimido(12a)azepin4(6H)one
309736229
C1CCC2=NC3=C(C(=CS3)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)N2CC1
InChI=1SC17H15N3O3Sc21171513(115712(8611)20(22)23)102416(15)18144213919(14)17h5810H149H2
MFCD00811825
O=c1n2CCCCCc2nc2c1c(cs2)c1ccc(cc1)(N+)(=O)(O)
ZINC000000207032
ZINC00207032
ZINC207032
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