1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2-methoxy-5-methyl-phenyl)urea

Systemtic Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2-methoxy-5-methyl-phenyl)urea Openeye Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2-methoxy-5-methyl-phenyl)urea CAS Name: 1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-3-(2-methoxy-5-methylphenyl)urea IUPAC Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(2-methoxy-5-methylphenyl)urea Traditional Name: 1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-(2-methoxy-5-methyl-phenyl)urea Formula: C21H22FN3O2 MolecularWeight: 367.416683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)NCC2=CC=CN2CC3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)NCC2=CC=CN2CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H22FN3O2/c1-15-8-9-20(27-2)19(11-15)24-21(26)23-13-18-7-4-10-25(18)14-16-5-3-6-17(22)12-16/h3-12H,13-14H2,1-2H3,(H2,23,24,26)