(2S)-2-azanyl-3-methyl-N-[6-oxidanylidene-7-(4-phenylbutyl)-7H-benzo[d][1]benzazepin-5-yl]butanamide

Systemtic Name: (2S)-2-azanyl-3-methyl-N-[6-oxidanylidene-7-(4-phenylbutyl)-7H-benzo[d][1]benzazepin-5-yl]butanamide Openeye Name: (2S)-2-amino-3-methyl-N-[6-oxo-7-(4-phenylbutyl)-7H-benzo[d][1]benzazepin-5-yl]butanamide CAS Name: (2S)-2-amino-3-methyl-N-[6-oxo-7-(4-phenylbutyl)-7H-benzo[d][1]benzazepin-5-yl]butanamide IUPAC Name: (2S)-2-amino-3-methyl-N-[6-oxo-7-(4-phenylbutyl)-7H-benzo[d][1]benzazepin-5-yl]butanamide Traditional Name: (2S)-2-amino-N-[6-keto-7-(4-phenylbutyl)-7H-benzo[d][1]benzazepin-5-yl]-3-methyl-butyramide Formula: C29H33N3O2 MolecularWeight: 455.59122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NN1C2=CC=CC=C2C3=CC=CC=C3C(C1=O)CCCCC4=CC=CC=C4)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NN1C2=CC=CC=C2C3=CC=CC=C3C(C1=O)CCCCC4=CC=CC=C4)N

InChI

InChI=1S/C29H33N3O2/c1-20(2)27(30)28(33)31-32-26-19-11-10-17-24(26)22-15-8-9-16-23(22)25(29(32)34)18-7-6-14-21-12-4-3-5-13-21/h3-5,8-13,15-17,19-20,25,27H,6-7,14,18,30H2,1-2H3,(H,31,33)/t25?,27-/m0/s1