1-(4-bromophenyl)-3-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]thiourea

Systemtic Name: 1-(4-bromophenyl)-3-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]thiourea Openeye Name: 1-(4-bromophenyl)-3-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]thiourea CAS Name: 1-(4-bromophenyl)-3-[1-[(2-fluorophenyl)methyl]-3-pyrazolyl]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]thiourea Traditional Name: 1-(4-bromophenyl)-3-[1-(2-fluorobenzyl)pyrazol-3-yl]thiourea Formula: C17H14BrFN4S MolecularWeight: 405.287263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC(=N2)NC(=S)NC3=CC=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC(=N2)NC(=S)NC3=CC=C(C=C3)Br)F

InChI

InChI=1S/C17H14BrFN4S/c18-13-5-7-14(8-6-13)20-17(24)21-16-9-10-23(22-16)11-12-3-1-2-4-15(12)19/h1-10H,11H2,(H2,20,21,22,24)