1-(4-bromanyl-2-chloranyl-phenyl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[1-[(4-fluorophenyl)methyl]-3-pyrazolyl]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[1-(4-fluorobenzyl)pyrazol-3-yl]thiourea Formula: C17H13BrClFN4S MolecularWeight: 439.732323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CC(=N2)NC(=S)NC3=C(C=C(C=C3)Br)Cl)F

Isomeric SMILES

C1=CC(=CC=C1CN2C=CC(=N2)NC(=S)NC3=C(C=C(C=C3)Br)Cl)F

InChI

InChI=1S/C17H13BrClFN4S/c18-12-3-6-15(14(19)9-12)21-17(25)22-16-7-8-24(23-16)10-11-1-4-13(20)5-2-11/h1-9H,10H2,(H2,21,22,23,25)