3-ethyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea

Systemtic Name: 3-ethyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea Openeye Name: 1-allyl-3-ethyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea CAS Name: 3-ethyl-1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-1-prop-2-enylurea IUPAC Name: 3-ethyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enylurea Traditional Name: 1-allyl-3-ethyl-1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]urea Formula: C18H22FN3O MolecularWeight: 315.385183

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(CC=C)CC1=CC=CN1CC2=CC(=CC=C2)F

Isomeric SMILES

CCNC(=O)N(CC=C)CC1=CC=CN1CC2=CC(=CC=C2)F

InChI

InChI=1S/C18H22FN3O/c1-3-10-22(18(23)20-4-2)14-17-9-6-11-21(17)13-15-7-5-8-16(19)12-15/h3,5-9,11-12H,1,4,10,13-14H2,2H3,(H,20,23)