1-[1-[(2-fluorophenyl)methyl]pyrrolidin-3-yl]-3-(3-methylisoquinolin-5-yl)urea

Systemtic Name: 1-[1-[(2-fluorophenyl)methyl]pyrrolidin-3-yl]-3-(3-methylisoquinolin-5-yl)urea Openeye Name: 1-[1-[(2-fluorophenyl)methyl]pyrrolidin-3-yl]-3-(3-methyl-5-isoquinolyl)urea CAS Name: 1-[1-[(2-fluorophenyl)methyl]-3-pyrrolidinyl]-3-(3-methyl-5-isoquinolinyl)urea IUPAC Name: 1-[1-[(2-fluorophenyl)methyl]pyrrolidin-3-yl]-3-(3-methylisoquinolin-5-yl)urea Traditional Name: 1-[1-(2-fluorobenzyl)pyrrolidin-3-yl]-3-(3-methyl-5-isoquinolyl)urea Formula: C22H23FN4O MolecularWeight: 378.442623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NC3CCN(C3)CC4=CC=CC=C4F

Isomeric SMILES

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NC3CCN(C3)CC4=CC=CC=C4F

InChI

InChI=1S/C22H23FN4O/c1-15-11-19-16(12-24-15)6-4-8-21(19)26-22(28)25-18-9-10-27(14-18)13-17-5-2-3-7-20(17)23/h2-8,11-12,18H,9-10,13-14H2,1H3,(H2,25,26,28)