1-[(4-fluorophenyl)methyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Traditional Name: 1-(4-fluorobenzyl)-3-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C20H22FN3O2 MolecularWeight: 355.405983

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O2/c1-2-19(25)24-10-9-15-5-8-18(11-16(15)13-24)23-20(26)22-12-14-3-6-17(21)7-4-14/h3-8,11H,2,9-10,12-13H2,1H3,(H2,22,23,26)