1-[2-oxidanylidene-1-[[3-(propan-2-ylcarbamoylamino)phenyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]-3-quinolin-3-yl-urea

Systemtic Name: 1-[2-oxidanylidene-1-[[3-(propan-2-ylcarbamoylamino)phenyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]-3-quinolin-3-yl-urea Openeye Name: 1-isopropyl-3-[3-[[2-oxo-3-(3-quinolylcarbamoylamino)-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]urea CAS Name: 1-[2-oxo-1-[[3-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]-3-(3-quinolinyl)urea IUPAC Name: 1-[2-oxo-1-[[3-(propan-2-ylcarbamoylamino)phenyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]-3-quinolin-3-ylurea Traditional Name: 1-isopropyl-3-[3-[[2-keto-3-(3-quinolylcarbamoylamino)-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]urea Formula: C31H32N6O3 MolecularWeight: 536.62418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=CC(=C1)CN2C3=CC=CC=C3CCC(C2=O)NC(=O)NC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CC(C)NC(=O)NC1=CC=CC(=C1)CN2C3=CC=CC=C3CCC(C2=O)NC(=O)NC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C31H32N6O3/c1-20(2)33-30(39)34-24-11-7-8-21(16-24)19-37-28-13-6-4-9-22(28)14-15-27(29(37)38)36-31(40)35-25-17-23-10-3-5-12-26(23)32-18-25/h3-13,16-18,20,27H,14-15,19H2,1-2H3,(H2,33,34,39)(H2,35,36,40)