Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL430120
SMILES O=C(c1cc2OCCCOc2cc1C)Nc1cccc(c1C)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 C18H18ClNO3 MW 331.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClNO3/c1-11-9-16-17(23-8-4-7-22-16)10-13(11)18(21)20-15-6-3-5-14(19)12(15)2/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,20,21)InChIKey
HTDXAYRQTXVJPU-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1C(=O)NC3=C(C(=CC=C3)Cl)C)OCCCO2
InChI=1SC18H18ClNO3c11191617(238472216)1013(11)18(21)201563514(19)12(15)2h356910H478H212H3(H2021)
MFCD27220777
N(3chloro2methylphenyl)8methyl34dihydro2H15benzodioxepine7carboxamide
ZINC000046077751
ZINC46077751
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