1-[2-(azepan-1-yl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[2-(azepan-1-yl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[2-(azepan-1-yl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[2-(1-azepanyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[2-(azepan-1-yl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[2-(azepan-1-yl)ethyl]-3-(4-fluorobenzyl)thiourea Formula: C16H24FN3S MolecularWeight: 309.445263

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

C1CCCN(CC1)CCNC(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C16H24FN3S/c17-15-7-5-14(6-8-15)13-19-16(21)18-9-12-20-10-3-1-2-4-11-20/h5-8H,1-4,9-13H2,(H2,18,19,21)