1-(phenylmethyl)-1-propan-2-yl-3-(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)urea

Systemtic Name: 1-(phenylmethyl)-1-propan-2-yl-3-(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)urea Openeye Name: 1-benzyl-1-isopropyl-3-(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolyl)urea CAS Name: 1-(phenylmethyl)-1-propan-2-yl-3-(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinyl)urea IUPAC Name: 1-benzyl-1-propan-2-yl-3-(2,6,7-trimethyl-1-oxo-4-phenylisoquinolin-3-yl)urea Traditional Name: 1-benzyl-1-isopropyl-3-(1-keto-2,6,7-trimethyl-4-phenyl-3-isoquinolyl)urea Formula: C29H31N3O2 MolecularWeight: 453.57534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)NC(=O)N(CC3=CC=CC=C3)C(C)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)NC(=O)N(CC3=CC=CC=C3)C(C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C29H31N3O2/c1-19(2)32(18-22-12-8-6-9-13-22)29(34)30-27-26(23-14-10-7-11-15-23)24-16-20(3)21(4)17-25(24)28(33)31(27)5/h6-17,19H,18H2,1-5H3,(H,30,34)