Vitas-M small molecule compound

3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK138915
SMILES CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)c1ccc(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 C30H30ClN3O2 MW 500.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30ClN3O2/c1-4-28(36)34-26-8-6-5-7-24(26)32-25-17-21(19-9-13-22(31)14-10-19)18-27(35)29(25)30(34)20-11-15-23(16-12-20)33(2)3/h5-16,21,30,32H,4,17-18H2,1-3H3
InChIKey
HDPIVSMPIGAEOR-UHFFFAOYSA-N
Synonyms

3(4chlorophenyl)11(4(dimethylamino)phenyl)10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4chlorophenyl)6(4(dimethylamino)phenyl)5propanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)Cl)NC4=CC=CC=C41)C5=CC=C(C=C5)N(C)C
InChI=1SC30H30ClN3O2c1428(36)3426865724(26)32251721(1991322(31)141019)1827(35)29(25)30(34)20111523(161220)33(2)3h516213032H41718H213H3
MFCD02375488
ZINC000001178697
ZINC000001178700

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Available files

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