Vitas-M small molecule compound
10-ethoxy-3-(2-methoxyethyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Catalog ID
STL094408
SMILES COCCN1C(=S)NC2CC1(C)Oc1c2cccc1OCC
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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 C16H22N2O3S MW 322.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O3S/c1-4-20-13-7-5-6-11-12-10-16(2,21-14(11)13)18(8-9-19-3)15(22)17-12/h5-7,12H,4,8-10H2,1-3H3,(H,17,22)InChIKey
GGJPMNCHEILAMY-UHFFFAOYSA-NSynonyms
702656-00-610ethoxy3(2methoxyethyl)2methyl2356tetrahydro4H26methano135benzoxadiazocine4thione
702656006
CCOC1=CC=CC2=C1OC3(CC2NC(=S)N3CCOC)C
InChI=1SC16H22N2O3Sc14201375611121016(22114(11)13)18(89193)15(22)1712h5712H4810H213H3(H1722)
MFCD18788139
ZINC000100032137
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