Vitas-M small molecule compound
10-[(4-chlorophenyl)acetyl]-11-(3,4-dimethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL023655
SMILES COc1ccc(cc1OC)C1C2=C(Nc3c(N1C(=O)Cc1ccc(cc1)Cl)cccc3)CC(CC2=O)(C)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 C31H31ClN2O4 MW 531.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31ClN2O4/c1-31(2)17-23-29(25(35)18-31)30(20-11-14-26(37-3)27(16-20)38-4)34(24-8-6-5-7-22(24)33-23)28(36)15-19-9-12-21(32)13-10-19/h5-14,16,30,33H,15,17-18H2,1-4H3InChIKey
KZEZSTFNORGPBD-UHFFFAOYSA-NSynonyms
10((4chlorophenyl)acetyl)11(34dimethoxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5(2(4chlorophenyl)acetyl)6(34dimethoxyphenyl)99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)CC4=CC=C(C=C4)Cl)C5=CC(=C(C=C5)OC)OC)C(=O)C1)C
InChI=1SC31H31ClN2O4c131(2)172329(25(35)1831)30(20111426(373)27(1620)384)34(24865722(24)3323)28(36)151991221(32)131019h514163033H151718H214H3
MFCD01919415
ZINC000000997759
ZINC000000997760
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