1-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-(4-chlorophenyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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