3-(4-ethoxyphenyl)-1-hexyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]urea

Systemtic Name: 3-(4-ethoxyphenyl)-1-hexyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]urea Openeye Name: 3-(4-ethoxyphenyl)-1-hexyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]urea CAS Name: 3-(4-ethoxyphenyl)-1-hexyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]urea IUPAC Name: 3-(4-ethoxyphenyl)-1-hexyl-1-[2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]urea Traditional Name: 1-hexyl-1-[2-keto-2-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-p-phenetyl-urea Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C27H37N3O3/c1-4-6-7-10-18-29(27(32)28-23-13-15-24(16-14-23)33-5-2)20-26(31)30-19-17-22-11-8-9-12-25(22)21(30)3/h8-9,11-16,21H,4-7,10,17-20H2,1-3H3,(H,28,32)