Vitas-M small molecule compound
8-chloro-2,11-dimethyl-3-(3-methylphenyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Catalog ID
STL094521
SMILES Clc1ccc2c(c1)C1NC(=S)N(C(O2)(C1C)C)c1cccc(c1)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 C19H19ClN2OS MW 358.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2OS/c1-11-5-4-6-14(9-11)22-18(24)21-17-12(2)19(22,3)23-16-8-7-13(20)10-15(16)17/h4-10,12,17H,1-3H3,(H,21,24)InChIKey
ACBUEXNZPIERBZ-UHFFFAOYSA-NSynonyms
8chloro211dimethyl3(3methylphenyl)2356tetrahydro4H26methano135benzoxadiazocine4thione
CC1C2C3=C(C=CC(=C3)Cl)OC1(N(C(=S)N2)C4=CC=CC(=C4)C)C
InChI=1SC19H19ClN2OSc11154614(911)2218(24)211712(2)19(223)23168713(20)1015(16)17h4101217H13H3(H2124)
MFCD14725978
ZINC000101269698
ZINC000230078608
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