1-(4-fluorophenyl)-3-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]thiourea Openeye Name: 1-(4-fluorophenyl)-3-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyleneamino]thiourea CAS Name: 1-(4-fluorophenyl)-3-[(E)-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylideneamino]thiourea Traditional Name: 1-(4-fluorophenyl)-3-[(E)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methyleneamino]thiourea Formula: C22H23FN6S MolecularWeight: 422.521623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=S)NC2=CC=C(C=C2)F)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=S)NC2=CC=C(C=C2)F)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23FN6S/c1-16-20(15-24-26-22(30)25-18-11-9-17(23)10-12-18)21(28-13-5-6-14-28)29(27-16)19-7-3-2-4-8-19/h2-4,7-12,15H,5-6,13-14H2,1H3,(H2,25,26,30)/b24-15+