Vitas-M small molecule compound

8-methoxy-3-(2-methoxyphenyl)-N-(4-methoxyphenyl)-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide

Catalog ID
STL141938
SMILES COc1ccc(cc1)NC(=O)C1C2NC(=S)N(C1(C)Oc1c2cc(OC)cc1)c1ccccc1OC

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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 C27H27N3O5S MW 505.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O5S/c1-27-23(25(31)28-16-9-11-17(32-2)12-10-16)24(19-15-18(33-3)13-14-21(19)35-27)29-26(36)30(27)20-7-5-6-8-22(20)34-4/h5-15,23-24H,1-4H3,(H,28,31)(H,29,36)
InChIKey
DAXNYHUKPMNOER-UHFFFAOYSA-N
Synonyms
1351842-33-5
1351842335
8methoxy3(2methoxyphenyl)N(4methoxyphenyl)2methyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
CC12C(C(C3=C(O1)C=CC(=C3)OC)NC(=S)N2C4=CC=CC=C4OC)C(=O)NC5=CC=C(C=C5)OC
InChI=1SC27H27N3O5Sc12723(25(31)281691117(322)121016)24(191518(333)131421(19)3527)2926(36)30(27)20756822(20)344h5152324H14H3(H2831)(H2936)
MFCD20735580
ZINC000106803960
ZINC000106803964

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Available files

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