3-(cyclobutylmethyl)-N'-[6-oxidanylidene-5-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]-7H-benzo[d][1]benzazepin-7-yl]-2-prop-2-enyl-butanediamide

Systemtic Name: 3-(cyclobutylmethyl)-N'-[6-oxidanylidene-5-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]-7H-benzo[d][1]benzazepin-7-yl]-2-prop-2-enyl-butanediamide Openeye Name: 2-allyl-3-(cyclobutylmethyl)-N'-[6-oxo-5-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]-7H-benzo[d][1]benzazepin-7-yl]butanediamide CAS Name: 3-(cyclobutylmethyl)-N'-[6-oxo-5-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]-7H-benzo[d][1]benzazepin-7-yl]-2-prop-2-enylbutanediamide IUPAC Name: 3-(cyclobutylmethyl)-N'-[6-oxo-5-[[3-[4-(trifluoromethyl)phenyl]phenyl]methyl]-7H-benzo[d][1]benzazepin-7-yl]-2-prop-2-enylbutanediamide Traditional Name: 2-allyl-3-(cyclobutylmethyl)-N'-[6-keto-5-[3-[4-(trifluoromethyl)phenyl]benzyl]-7H-benzo[d][1]benzazepin-7-yl]succinamide Formula: C40H38F3N3O3 MolecularWeight: 665.74323

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C(CC1CCC1)C(=O)NC2C3=CC=CC=C3C4=CC=CC=C4N(C2=O)CC5=CC=CC(=C5)C6=CC=C(C=C6)C(F)(F)F)C(=O)N

Isomeric SMILES

C=CCC(C(CC1CCC1)C(=O)NC2C3=CC=CC=C3C4=CC=CC=C4N(C2=O)CC5=CC=CC(=C5)C6=CC=C(C=C6)C(F)(F)F)C(=O)N

InChI

InChI=1S/C40H38F3N3O3/c1-2-9-33(37(44)47)34(23-25-10-7-11-25)38(48)45-36-32-16-4-3-14-30(32)31-15-5-6-17-35(31)46(39(36)49)24-26-12-8-13-28(22-26)27-18-20-29(21-19-27)40(41,42)43/h2-6,8,12-22,25,33-34,36H,1,7,9-11,23-24H2,(H2,44,47)(H,45,48)