2-[4-[[3-(3-azanylbutanoylamino)-4,5-dimethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]-N-ethyl-benzamide

Systemtic Name: 2-[4-[[3-(3-azanylbutanoylamino)-4,5-dimethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]-N-ethyl-benzamide Openeye Name: 2-[4-[[3-(3-aminobutanoylamino)-4,5-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]-N-ethyl-benzamide CAS Name: 2-[4-[[3-[(3-amino-1-oxobutyl)amino]-4,5-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]-N-ethylbenzamide IUPAC Name: 2-[4-[[3-(3-aminobutanoylamino)-4,5-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]-N-ethylbenzamide Traditional Name: 2-[4-[[3-(3-aminobutanoylamino)-2-keto-4,5-dimethyl-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]-N-ethyl-benzamide Formula: C32H38N4O3 MolecularWeight: 526.66912

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=CC=C1C2=CC=C(C=C2)CN3C4=CC=CC=C4C(C(C(C3=O)NC(=O)CC(C)N)C)C

Isomeric SMILES

CCNC(=O)C1=CC=CC=C1C2=CC=C(C=C2)CN3C4=CC=CC=C4C(C(C(C3=O)NC(=O)CC(C)N)C)C

InChI

InChI=1S/C32H38N4O3/c1-5-34-31(38)27-12-7-6-11-26(27)24-16-14-23(15-17-24)19-36-28-13-9-8-10-25(28)21(3)22(4)30(32(36)39)35-29(37)18-20(2)33/h6-17,20-22,30H,5,18-19,33H2,1-4H3,(H,34,38)(H,35,37)