1-isoquinolin-5-yl-3-(2,2,6-trimethyl-3,4-dihydrochromen-4-yl)urea

Systemtic Name: 1-isoquinolin-5-yl-3-(2,2,6-trimethyl-3,4-dihydrochromen-4-yl)urea Openeye Name: 1-(5-isoquinolyl)-3-(2,2,6-trimethylchroman-4-yl)urea CAS Name: 1-(5-isoquinolinyl)-3-(2,2,6-trimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)urea IUPAC Name: 1-isoquinolin-5-yl-3-(2,2,6-trimethyl-3,4-dihydrochromen-4-yl)urea Traditional Name: 1-(5-isoquinolyl)-3-(2,2,6-trimethylchroman-4-yl)urea Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CC2NC(=O)NC3=CC=CC4=C3C=CN=C4)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OC(CC2NC(=O)NC3=CC=CC4=C3C=CN=C4)(C)C

InChI

InChI=1S/C22H23N3O2/c1-14-7-8-20-17(11-14)19(12-22(2,3)27-20)25-21(26)24-18-6-4-5-15-13-23-10-9-16(15)18/h4-11,13,19H,12H2,1-3H3,(H2,24,25,26)