Vitas-M small molecule compound
2,11-dimethyl-3-[3-(methylsulfanyl)phenyl]-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Catalog ID
STL094498
SMILES CSc1cccc(c1)N1C(=S)NC2C(C1(C)Oc1c2cccc1)C
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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 C19H20N2OS2 MW 356.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2OS2/c1-12-17-15-9-4-5-10-16(15)22-19(12,2)21(18(23)20-17)13-7-6-8-14(11-13)24-3/h4-12,17H,1-3H3,(H,20,23)InChIKey
XAGQLSGNKZKLJZ-UHFFFAOYSA-NSynonyms
211dimethyl3(3(methylsulfanyl)phenyl)2356tetrahydro4H26methano135benzoxadiazocine4thione
CC1C2C3=CC=CC=C3OC1(N(C(=S)N2)C4=CC(=CC=C4)SC)C
InChI=1SC19H20N2OS2c11217159451016(15)2219(122)21(18(23)2017)1376814(1113)243h41217H13H3(H2023)
MFCD14749842
ZINC000101390427
ZINC000101390431
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