1-[(4-fluorophenyl)methyl]-3-[3-(2-oxidanylideneazepan-1-yl)propyl]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[3-(2-oxidanylideneazepan-1-yl)propyl]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[3-(2-oxoazepan-1-yl)propyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[3-(2-oxo-1-azepanyl)propyl]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[3-(2-oxoazepan-1-yl)propyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[3-(2-ketoazepan-1-yl)propyl]thiourea Formula: C17H24FN3OS MolecularWeight: 337.455363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C17H24FN3OS/c18-15-8-6-14(7-9-15)13-20-17(23)19-10-4-12-21-11-3-1-2-5-16(21)22/h6-9H,1-5,10-13H2,(H2,19,20,23)