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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-oxidanylidene-1-[[3-(propan-2-ylcarbamoylamino)phenyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[[3-(isopropylcarbamoylamino)phenyl]methyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-oxo-1-[[3-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-oxo-1-[[3-(propan-2-ylcarbamoylamino)phenyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[3-(isopropylcarbamoylamino)benzyl]-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl]urea Formula: C29H31N5O5 MolecularWeight: 529.58694

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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=C(C=C4)OCO5

Isomeric SMILES

CC(C)NC(=O)NC1=CC=CC(=C1)CN2C3=CC=CC=C3CCC(C2=O)NC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H31N5O5/c1-18(2)30-28(36)31-21-8-5-6-19(14-21)16-34-24-9-4-3-7-20(24)10-12-23(27(34)35)33-29(37)32-22-11-13-25-26(15-22)39-17-38-25/h3-9,11,13-15,18,23H,10,12,16-17H2,1-2H3,(H2,30,31,36)(H2,32,33,37)