1-(3-methylisoquinolin-5-yl)-3-[(4-propan-2-ylphenyl)methyl]urea

Systemtic Name: 1-(3-methylisoquinolin-5-yl)-3-[(4-propan-2-ylphenyl)methyl]urea Openeye Name: 1-[(4-isopropylphenyl)methyl]-3-(3-methyl-5-isoquinolyl)urea CAS Name: 1-(3-methyl-5-isoquinolinyl)-3-[(4-propan-2-ylphenyl)methyl]urea IUPAC Name: 1-(3-methylisoquinolin-5-yl)-3-[(4-propan-2-ylphenyl)methyl]urea Traditional Name: 1-(4-isopropylbenzyl)-3-(3-methyl-5-isoquinolyl)urea Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NCC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NCC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H23N3O/c1-14(2)17-9-7-16(8-10-17)12-23-21(25)24-20-6-4-5-18-13-22-15(3)11-19(18)20/h4-11,13-14H,12H2,1-3H3,(H2,23,24,25)