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

Systemtic Name: 1-[4-bromanyl-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-cyclopentyl-thiourea Openeye Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-cyclopentyl-thiourea CAS Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]-3-pyrazolyl]-3-cyclopentylthiourea IUPAC Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-cyclopentylthiourea Traditional Name: 1-[4-bromo-1-(4-chlorobenzyl)pyrazol-3-yl]-3-cyclopentyl-thiourea Formula: C16H18BrClN4S MolecularWeight: 413.76292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NC2=NN(C=C2Br)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(C1)NC(=S)NC2=NN(C=C2Br)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H18BrClN4S/c17-14-10-22(9-11-5-7-12(18)8-6-11)21-15(14)20-16(23)19-13-3-1-2-4-13/h5-8,10,13H,1-4,9H2,(H2,19,20,21,23)