1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-[3-(1,3-oxazol-5-yl)phenyl]urea

Systemtic Name: 1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-[3-(1,3-oxazol-5-yl)phenyl]urea Openeye Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-3-(3-oxazol-5-ylphenyl)urea CAS Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-[3-(5-oxazolyl)phenyl]urea IUPAC Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-[3-(1,3-oxazol-5-yl)phenyl]urea Traditional Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-3-(3-oxazol-5-ylphenyl)urea Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)NC3=CC=CC(=C3)C4=CN=CO4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)NC3=CC=CC(=C3)C4=CN=CO4)O)C

InChI

InChI=1S/C22H20N4O4/c1-22(2)20(27)19(16-8-13(10-23)6-7-17(16)30-22)26-21(28)25-15-5-3-4-14(9-15)18-11-24-12-29-18/h3-9,11-12,19-20,27H,1-2H3,(H2,25,26,28)