1-[(4R)-6-fluoranyl-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-(3-methylisoquinolin-5-yl)urea

Systemtic Name: 1-[(4R)-6-fluoranyl-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-(3-methylisoquinolin-5-yl)urea Openeye Name: 1-[(4R)-6-fluoro-2,2-dimethyl-chroman-4-yl]-3-(3-methyl-5-isoquinolyl)urea CAS Name: 1-[(4R)-6-fluoro-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-3-(3-methyl-5-isoquinolinyl)urea IUPAC Name: 1-[(4R)-6-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-(3-methylisoquinolin-5-yl)urea Traditional Name: 1-[(4R)-6-fluoro-2,2-dimethyl-chroman-4-yl]-3-(3-methyl-5-isoquinolyl)urea Formula: C22H22FN3O2 MolecularWeight: 379.427383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NC3CC(OC4=C3C=C(C=C4)F)(C)C

Isomeric SMILES

CC1=NC=C2C=CC=C(C2=C1)NC(=O)N[C@@H]3CC(OC4=C3C=C(C=C4)F)(C)C

InChI

InChI=1S/C22H22FN3O2/c1-13-9-16-14(12-24-13)5-4-6-18(16)25-21(27)26-19-11-22(2,3)28-20-8-7-15(23)10-17(19)20/h4-10,12,19H,11H2,1-3H3,(H2,25,26,27)/t19-/m1/s1