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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)F

InChI

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