1-butyl-3-[2-methyl-4-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-8-yl]urea

Systemtic Name: 1-butyl-3-[2-methyl-4-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-8-yl]urea Openeye Name: 1-butyl-3-[2-methyl-4-(p-tolyl)-3,4-dihydro-1H-isoquinolin-8-yl]urea CAS Name: 1-butyl-3-[2-methyl-4-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-8-yl]urea IUPAC Name: 1-butyl-3-[2-methyl-4-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-8-yl]urea Traditional Name: 1-butyl-3-[2-methyl-4-(p-tolyl)-3,4-dihydro-1H-isoquinolin-8-yl]urea Formula: C22H29N3O MolecularWeight: 351.48516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=CC2=C1CN(CC2C3=CC=C(C=C3)C)C

Isomeric SMILES

CCCCNC(=O)NC1=CC=CC2=C1CN(CC2C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H29N3O/c1-4-5-13-23-22(26)24-21-8-6-7-18-19(14-25(3)15-20(18)21)17-11-9-16(2)10-12-17/h6-12,19H,4-5,13-15H2,1-3H3,(H2,23,24,26)