1-(4-butylphenyl)-3-[(2-fluorophenyl)methyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(2-fluorophenyl)methyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(2-fluorophenyl)methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[(2-fluorophenyl)methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(2-fluorophenyl)methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-(2-fluorobenzyl)thiourea Formula: C18H21FN2S MolecularWeight: 316.436143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2F

InChI

InChI=1S/C18H21FN2S/c1-2-3-6-14-9-11-16(12-10-14)21-18(22)20-13-15-7-4-5-8-17(15)19/h4-5,7-12H,2-3,6,13H2,1H3,(H2,20,21,22)