1-(4-butan-2-yl-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-(4-propan-2-ylphenyl)urea

Systemtic Name: 1-(4-butan-2-yl-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-(4-propan-2-ylphenyl)urea Openeye Name: 1-(4-isopropylphenyl)-3-(2-methyl-3-oxo-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)urea CAS Name: 1-(4-butan-2-yl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(4-propan-2-ylphenyl)urea IUPAC Name: 1-(4-butan-2-yl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(4-propan-2-ylphenyl)urea Traditional Name: 1-(3-keto-2-methyl-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)-3-p-cumenyl-urea Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CC2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(C)C)OC(C1=O)C

Isomeric SMILES

CCC(C)N1CC2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(C)C)OC(C1=O)C

InChI

InChI=1S/C24H31N3O3/c1-6-16(4)27-14-19-13-21(11-12-22(19)30-17(5)23(27)28)26-24(29)25-20-9-7-18(8-10-20)15(2)3/h7-13,15-17H,6,14H2,1-5H3,(H2,25,26,29)