Vitas-M small molecule compound
11-(3-butoxyphenyl)-10-(2-ethylhexanoyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK132792
SMILES CCCCOc1cccc(c1)C1C2=C(Nc3c(N1C(=O)C(CCCC)CC)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 C33H44N2O3 MW 516.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H44N2O3/c1-6-9-14-23(8-3)32(37)35-28-18-12-11-17-26(28)34-27-21-33(4,5)22-29(36)30(27)31(35)24-15-13-16-25(20-24)38-19-10-7-2/h11-13,15-18,20,23,31,34H,6-10,14,19,21-22H2,1-5H3InChIKey
KGYMHKNNSBSTMO-UHFFFAOYSA-NSynonyms
371118-57-911(3butoxyphenyl)10(2ethylhexanoyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
371118579
6(3butoxyphenyl)5(2ethylhexanoyl)99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCC(CC)C(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC(=CC=C4)OCCCC
InChI=1SC33H44N2O3c1691423(83)32(37)35281812111726(28)34272133(45)2229(36)30(27)31(35)2415131625(2024)38191072h1113151820233134H61014192122H215H3
MFCD01921823
ZINC000018180741
ZINC000018180750
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