Vitas-M small molecule compound
3,3-dimethyl-11-(4-nitrophenyl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK016556
SMILES CCC(=O)N1C(c2ccc(cc2)[N+](=O)[O-])C2=C(Nc3c1cccc3)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 C24H25N3O4 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4/c1-4-21(29)26-19-8-6-5-7-17(19)25-18-13-24(2,3)14-20(28)22(18)23(26)15-9-11-16(12-10-15)27(30)31/h5-12,23,25H,4,13-14H2,1-3H3InChIKey
CPDPQICDXRDYHM-UHFFFAOYSA-NSynonyms
33dimethyl11(4nitrophenyl)10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
99dimethyl6(4nitrophenyl)5propanoyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC=C(C=C4)(N+)(=O)(O)
CCC(=O)N1C(c2ccc(cc2)(N+)(=O)(O))C2=C(Nc3c1cccc3)CC(CC2=O)(C)C
InChI=1SC24H25N3O4c1421(29)2619865717(19)25181324(23)1420(28)22(18)23(26)1591116(121015)27(30)31h5122325H41314H213H3
MFCD01447270
STK016556
ZINC000000995937
ZINC000000995938
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