1-isoquinolin-5-yl-3-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)urea

Systemtic Name: 1-isoquinolin-5-yl-3-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)urea Openeye Name: 1-(5-isoquinolyl)-3-(7-methoxy-2,2-dimethyl-chroman-4-yl)urea CAS Name: 1-(5-isoquinolinyl)-3-(7-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)urea IUPAC Name: 1-isoquinolin-5-yl-3-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)urea Traditional Name: 1-(5-isoquinolyl)-3-(7-methoxy-2,2-dimethyl-chroman-4-yl)urea Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=C(C=C2)OC)NC(=O)NC3=CC=CC4=C3C=CN=C4)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=C(C=C2)OC)NC(=O)NC3=CC=CC4=C3C=CN=C4)C

InChI

InChI=1S/C22H23N3O3/c1-22(2)12-19(17-8-7-15(27-3)11-20(17)28-22)25-21(26)24-18-6-4-5-14-13-23-10-9-16(14)18/h4-11,13,19H,12H2,1-3H3,(H2,24,25,26)