Vitas-M small molecule compound

10-(4-bromo-3-methylphenyl)-7-methyl-1,2,3,4,10,11-hexahydro-5H,9H-benzo[3,4]chromeno[6,7-e][1,3]oxazin-5-one

Catalog ID
STL235035
SMILES Brc1ccc(cc1C)N1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCCC2

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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 C23H22BrNO3 MW 440.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrNO3/c1-13-9-16(7-8-20(13)24)25-11-15-10-19-17-5-3-4-6-18(17)23(26)28-22(19)14(2)21(15)27-12-25/h7-10H,3-6,11-12H2,1-2H3
InChIKey
MCICDVZWAVRVJW-UHFFFAOYSA-N
Synonyms
848995-35-7
10(4bromo3methylphenyl)7methyl12341011hexahydro5H9Hbenzo(34)chromeno(67e)(13)oxazin5one
10(4bromo3methylphenyl)7methyl12341011hexahydrobenzo(34)chromeno(67e)(13)oxazin5(9H)one
10(4bromo3methylphenyl)7methyl1234911hexahydroisochromeno(43g)(13)benzoxazin5one
848995357
CC1=C(C=CC(=C1)N2CC3=C(C(=C4C(=C3)C5=C(CCCC5)C(=O)O4)C)OC2)Br
InChI=1SC23H22BrNO3c113916(7820(13)24)251115101917534618(17)23(26)2822(19)14(2)21(15)271225h710H361112H212H3
MFCD05679399
ZINC000002447499
ZINC02447499
ZINC2447499

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Available files

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