Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Catalog ID
STK932193
SMILES O=C(c1ccc2c(c1)nc1n(c2=O)CCCCC1)NC1CCS(=O)(=O)C1
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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 C18H21N3O4S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O4S/c22-17(19-13-7-9-26(24,25)11-13)12-5-6-14-15(10-12)20-16-4-2-1-3-8-21(16)18(14)23/h5-6,10,13H,1-4,7-9,11H2,(H,19,22)InChIKey
NJHJGFUIAYGOKY-UHFFFAOYSA-NSynonyms
1190252-95-91190252959
C1CCC2=NC3=C(C=CC(=C3)C(=O)NC4CCS(=O)(=O)C4)C(=O)N2CC1
InChI=1SC18H21N3O4Sc2217(19137926(2425)1113)12561415(1012)20164213821(16)18(14)23h561013H147911H2(H1922)
MFCD13758495
N(11dioxidotetrahydrothiophen3yl)12oxo67891012hexahydroazepino(21b)quinazoline3carboxamide
N(11dioxothiolan3yl)12oxo78910tetrahydro6Hazepino(21b)quinazoline3carboxamide
ZINC000036359108
ZINC000036359109
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