1-(4-cyano-2-methyl-phenyl)-3-[3-(3,3-dimethyl-5-oxidanylidene-oxolan-2-yl)phenyl]urea

Systemtic Name: 1-(4-cyano-2-methyl-phenyl)-3-[3-(3,3-dimethyl-5-oxidanylidene-oxolan-2-yl)phenyl]urea Openeye Name: 1-(4-cyano-2-methyl-phenyl)-3-[3-(3,3-dimethyl-5-oxo-tetrahydrofuran-2-yl)phenyl]urea CAS Name: 1-(4-cyano-2-methylphenyl)-3-[3-(3,3-dimethyl-5-oxo-2-oxolanyl)phenyl]urea IUPAC Name: 1-(4-cyano-2-methylphenyl)-3-[3-(3,3-dimethyl-5-oxooxolan-2-yl)phenyl]urea Traditional Name: 1-(4-cyano-2-methyl-phenyl)-3-[3-(5-keto-3,3-dimethyl-tetrahydrofuran-2-yl)phenyl]urea Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#N)NC(=O)NC2=CC=CC(=C2)C3C(CC(=O)O3)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C#N)NC(=O)NC2=CC=CC(=C2)C3C(CC(=O)O3)(C)C

InChI

InChI=1S/C21H21N3O3/c1-13-9-14(12-22)7-8-17(13)24-20(26)23-16-6-4-5-15(10-16)19-21(2,3)11-18(25)27-19/h4-10,19H,11H2,1-3H3,(H2,23,24,26)