Vitas-M small molecule compound
3,11-bis(4-chlorophenyl)-10-hexanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL438730
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)Cl)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 C31H30Cl2N2O2 MW 533.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30Cl2N2O2/c1-2-3-4-9-29(37)35-27-8-6-5-7-25(27)34-26-18-22(20-10-14-23(32)15-11-20)19-28(36)30(26)31(35)21-12-16-24(33)17-13-21/h5-8,10-17,22,31,34H,2-4,9,18-19H2,1H3InChIKey
CQCWNWDQEVCYEO-UHFFFAOYSA-NSynonyms
311bis(4chlorophenyl)10hexanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
69bis(4chlorophenyl)5hexanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)Cl)NC4=CC=CC=C41)C5=CC=C(C=C5)Cl
InChI=1SC31H30Cl2N2O2c1234929(37)3527865725(27)34261822(20101423(32)151120)1928(36)30(26)31(35)21121624(33)171321h581017223134H2491819H21H3
MFCD06244659
ZINC000003772480
ZINC000008695574
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