3-azanyl-3-methyl-N-[5-methyl-1-[[4-[2-(methylcarbamoylamino)phenyl]phenyl]methyl]-2-oxidanylidene-3H-1-benzazepin-3-yl]butanamide

Systemtic Name: 3-azanyl-3-methyl-N-[5-methyl-1-[[4-[2-(methylcarbamoylamino)phenyl]phenyl]methyl]-2-oxidanylidene-3H-1-benzazepin-3-yl]butanamide Openeye Name: 3-amino-3-methyl-N-[5-methyl-1-[[4-[2-(methylcarbamoylamino)phenyl]phenyl]methyl]-2-oxo-3H-1-benzazepin-3-yl]butanamide CAS Name: 3-amino-3-methyl-N-[5-methyl-1-[[4-[2-(methylcarbamoylamino)phenyl]phenyl]methyl]-2-oxo-3H-1-benzazepin-3-yl]butanamide IUPAC Name: 3-amino-3-methyl-N-[5-methyl-1-[[4-[2-(methylcarbamoylamino)phenyl]phenyl]methyl]-2-oxo-3H-1-benzazepin-3-yl]butanamide Traditional Name: 3-amino-N-[2-keto-5-methyl-1-[4-[2-(methylcarbamoylamino)phenyl]benzyl]-3H-1-benzazepin-3-yl]-3-methyl-butyramide Formula: C31H35N5O3 MolecularWeight: 525.6413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(=O)N(C2=CC=CC=C12)CC3=CC=C(C=C3)C4=CC=CC=C4NC(=O)NC)NC(=O)CC(C)(C)N

Isomeric SMILES

CC1=CC(C(=O)N(C2=CC=CC=C12)CC3=CC=C(C=C3)C4=CC=CC=C4NC(=O)NC)NC(=O)CC(C)(C)N

InChI

InChI=1S/C31H35N5O3/c1-20-17-26(34-28(37)18-31(2,3)32)29(38)36(27-12-8-6-9-23(20)27)19-21-13-15-22(16-14-21)24-10-5-7-11-25(24)35-30(39)33-4/h5-17,26H,18-19,32H2,1-4H3,(H,34,37)(H2,33,35,39)