1-ethyl-3-[(Z)-[5-(4-fluoranylphenoxy)-3-methyl-1-phenyl-pyrazol-4-yl]methylideneamino]thiourea

Systemtic Name: 1-ethyl-3-[(Z)-[5-(4-fluoranylphenoxy)-3-methyl-1-phenyl-pyrazol-4-yl]methylideneamino]thiourea Openeye Name: 1-ethyl-3-[(Z)-[5-(4-fluorophenoxy)-3-methyl-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea CAS Name: 1-ethyl-3-[(Z)-[5-(4-fluorophenoxy)-3-methyl-1-phenyl-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-ethyl-3-[(Z)-[5-(4-fluorophenoxy)-3-methyl-1-phenylpyrazol-4-yl]methylideneamino]thiourea Traditional Name: 1-ethyl-3-[(Z)-[5-(4-fluorophenoxy)-3-methyl-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea Formula: C20H20FN5OS MolecularWeight: 397.469103

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(N(N=C1C)C2=CC=CC=C2)OC3=CC=C(C=C3)F

Isomeric SMILES

CCNC(=S)N/N=C\C1=C(N(N=C1C)C2=CC=CC=C2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FN5OS/c1-3-22-20(28)24-23-13-18-14(2)25-26(16-7-5-4-6-8-16)19(18)27-17-11-9-15(21)10-12-17/h4-13H,3H2,1-2H3,(H2,22,24,28)/b23-13-