1-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]thiourea CAS Name: 1-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]thiourea Formula: C14H14ClFN4S MolecularWeight: 324.804163

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=CN(N=C1)CC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

C=CCNC(=S)NC1=CN(N=C1)CC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C14H14ClFN4S/c1-2-5-17-14(21)19-12-7-18-20(9-12)8-10-3-4-11(16)6-13(10)15/h2-4,6-7,9H,1,5,8H2,(H2,17,19,21)