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

Systemtic Name: 1-(4-butan-2-yl-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-phenyl-urea Openeye Name: 1-(2-methyl-3-oxo-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)-3-phenyl-urea CAS Name: 1-(4-butan-2-yl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-phenylurea IUPAC Name: 1-(4-butan-2-yl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-phenylurea Traditional Name: 1-(3-keto-2-methyl-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)-3-phenyl-urea Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3/c1-4-14(2)24-13-16-12-18(10-11-19(16)27-15(3)20(24)25)23-21(26)22-17-8-6-5-7-9-17/h5-12,14-15H,4,13H2,1-3H3,(H2,22,23,26)