1-[3-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-3-phenyl-urea

Systemtic Name: 1-[3-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-3-phenyl-urea Openeye Name: 1-[3-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-propyl]-3-phenyl-urea CAS Name: 1-[3-[4-[(2-fluorophenyl)methyl]-1-piperazin-4-iumyl]-3-oxopropyl]-3-phenylurea IUPAC Name: 1-[3-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxopropyl]-3-phenylurea Traditional Name: 1-[3-[4-(2-fluorobenzyl)piperazin-4-ium-1-yl]-3-keto-propyl]-3-phenyl-urea Formula: C21H26FN4O2+ MolecularWeight: 385.455143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25FN4O2/c22-19-9-5-4-6-17(19)16-25-12-14-26(15-13-25)20(27)10-11-23-21(28)24-18-7-2-1-3-8-18/h1-9H,10-16H2,(H2,23,24,28)/p+1