Vitas-M small molecule compound
3-(4-tert-butylphenyl)-11-(2-chlorophenyl)-10-[(4-methoxyphenyl)carbonyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK261668
SMILES COc1ccc(cc1)C(=O)N1c2ccccc2NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)c1ccc(cc1)C(C)(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 C37H35ClN2O3 MW 591.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H35ClN2O3/c1-37(2,3)26-17-13-23(14-18-26)25-21-31-34(33(41)22-25)35(28-9-5-6-10-29(28)38)40(32-12-8-7-11-30(32)39-31)36(42)24-15-19-27(43-4)20-16-24/h5-20,25,35,39H,21-22H2,1-4H3InChIKey
HHHBYMJZJYDXGC-UHFFFAOYSA-NSynonyms
3(4(TERTBUTYL)PHENYL)11(2CHLOROPHENYL)10((4METHOXYPHENYL)CARBONYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
3(4tertbutylphenyl)11(2chlorophenyl)10((4methoxyphenyl)carbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4tertbutylphenyl)6(2chlorophenyl)5(4methoxybenzoyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(C)(C)C1=CC=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C5=CC=C(C=C5)OC)C6=CC=CC=C6Cl)C(=O)C2
InChI=1SC37H35ClN2O3c137(23)26171323(141826)25213134(33(41)2225)35(289561029(28)38)40(3212871130(32)3931)36(42)24151927(434)201624h520253539H2122H214H3
MFCD03946437
ZINC000005944487
ZINC000005944506
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