3-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-(3-methoxypropyl)urea

Systemtic Name: 3-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-(3-methoxypropyl)urea Openeye Name: 3-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-(3-methoxypropyl)urea CAS Name: 3-butyl-1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-1-(3-methoxypropyl)urea IUPAC Name: 3-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-(3-methoxypropyl)urea Traditional Name: 3-butyl-1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-1-(3-methoxypropyl)urea Formula: C21H30FN3O2 MolecularWeight: 375.480203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CCCOC)CC1=CC=CN1CC2=CC(=CC=C2)F

Isomeric SMILES

CCCCNC(=O)N(CCCOC)CC1=CC=CN1CC2=CC(=CC=C2)F

InChI

InChI=1S/C21H30FN3O2/c1-3-4-11-23-21(26)25(13-7-14-27-2)17-20-10-6-12-24(20)16-18-8-5-9-19(22)15-18/h5-6,8-10,12,15H,3-4,7,11,13-14,16-17H2,1-2H3,(H,23,26)