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

Systemtic Name: 1-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-ethyl-thiourea Openeye Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-ethyl-thiourea CAS Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-3-ethylthiourea IUPAC Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-ethylthiourea Traditional Name: 1-[4-bromo-1-(2-fluorobenzyl)pyrazol-3-yl]-3-ethyl-thiourea Formula: C13H14BrFN4S MolecularWeight: 357.244463

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=NN(C=C1Br)CC2=CC=CC=C2F

Isomeric SMILES

CCNC(=S)NC1=NN(C=C1Br)CC2=CC=CC=C2F

InChI

InChI=1S/C13H14BrFN4S/c1-2-16-13(20)17-12-10(14)8-19(18-12)7-9-5-3-4-6-11(9)15/h3-6,8H,2,7H2,1H3,(H2,16,17,18,20)