Vitas-M small molecule compound
N-(2,4-dimethylphenyl)-3-(4-ethoxyphenyl)-10-methoxy-2-methyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Catalog ID
STL192482
SMILES CCOc1ccc(cc1)N1C(=O)NC2C(C1(C)Oc1c2cccc1OC)C(=O)Nc1ccc(cc1C)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 C29H31N3O5 MW 501.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O5/c1-6-36-20-13-11-19(12-14-20)32-28(34)31-25-21-8-7-9-23(35-5)26(21)37-29(32,4)24(25)27(33)30-22-15-10-17(2)16-18(22)3/h7-16,24-25H,6H2,1-5H3,(H,30,33)(H,31,34)InChIKey
MVRFCDPNCRKLPQ-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)N2C(=O)NC3C(C2(OC4=C3C=CC=C4OC)C)C(=O)NC5=C(C=C(C=C5)C)C
InChI=1SC29H31N3O5c163620131119(121420)3228(34)31252187923(355)26(21)3729(324)24(25)27(33)3022151017(2)1618(22)3h7162425H6H215H3(H3033)(H3134)
MFCD22390721
N(24dimethylphenyl)3(4ethoxyphenyl)10methoxy2methyl4oxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
ZINC000100032706
ZINC000248247098
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