Vitas-M small molecule compound
N-(4-chlorophenyl)-10-methoxy-2-methyl-3-(3-methylphenyl)-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Catalog ID
STL166005
SMILES COc1cccc2c1OC1(C)C(C2NC(=S)N1c1cccc(c1)C)C(=O)Nc1ccc(cc1)Cl
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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 C26H24ClN3O3S MW 494.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3O3S/c1-15-6-4-7-18(14-15)30-25(34)29-22-19-8-5-9-20(32-3)23(19)33-26(30,2)21(22)24(31)28-17-12-10-16(27)11-13-17/h4-14,21-22H,1-3H3,(H,28,31)(H,29,34)InChIKey
LMNWFECRYMLTQQ-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)N2C(=S)NC3C(C2(OC4=C3C=CC=C4OC)C)C(=O)NC5=CC=C(C=C5)Cl
InChI=1SC26H24ClN3O3Sc11564718(1415)3025(34)29221985920(323)23(19)3326(302)21(22)24(31)2817121016(27)111317h4142122H13H3(H2831)(H2934)
MFCD15085913
N(4chlorophenyl)10methoxy2methyl3(3methylphenyl)4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
ZINC000100029842
ZINC000242548472
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