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

Systemtic Name: 1-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]thiourea CAS Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[4-bromo-1-(2-fluorobenzyl)pyrazol-3-yl]thiourea Formula: C14H14BrFN4S MolecularWeight: 369.255163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14BrFN4S/c1-2-7-17-14(21)18-13-11(15)9-20(19-13)8-10-5-3-4-6-12(10)16/h2-6,9H,1,7-8H2,(H2,17,18,19,21)