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

Systemtic Name: 1-[2-[[2-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)phenyl]amino]ethyl]urea Openeye Name: 2-[2-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)anilino]ethylurea CAS Name: 2-[2-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)anilino]ethylurea IUPAC Name: 2-[2-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)anilino]ethylurea Traditional Name: 2-[2-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)anilino]ethylurea Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)C3=CC=CC=C3NCCNC(=O)N)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)C3=CC=CC=C3NCCNC(=O)N)O)C

InChI

InChI=1S/C21H24N4O3/c1-21(2)19(26)18(15-11-13(12-22)7-8-17(15)28-21)14-5-3-4-6-16(14)24-9-10-25-20(23)27/h3-8,11,18-19,24,26H,9-10H2,1-2H3,(H3,23,25,27)