1-[4-chloranyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[4-chloranyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[4-chloro-1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]thiourea CAS Name: 1-[4-chloro-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-[4-chloro-1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[4-chloro-1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]thiourea Formula: C14H13Cl2FN4S MolecularWeight: 359.249223

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=NN(C=C1Cl)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C=CCNC(=S)NC1=NN(C=C1Cl)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C14H13Cl2FN4S/c1-2-6-18-14(22)19-13-11(16)8-21(20-13)7-9-10(15)4-3-5-12(9)17/h2-5,8H,1,6-7H2,(H2,18,19,20,22)