1-(2-cyanophenyl)-3-[2-(4-iodophenyl)-5-thiophen-2-yl-pyrazol-3-yl]urea

Systemtic Name: 1-(2-cyanophenyl)-3-[2-(4-iodophenyl)-5-thiophen-2-yl-pyrazol-3-yl]urea Openeye Name: 1-(2-cyanophenyl)-3-[2-(4-iodophenyl)-5-(2-thienyl)pyrazol-3-yl]urea CAS Name: 1-(2-cyanophenyl)-3-[2-(4-iodophenyl)-5-thiophen-2-yl-3-pyrazolyl]urea IUPAC Name: 1-(2-cyanophenyl)-3-[2-(4-iodophenyl)-5-thiophen-2-ylpyrazol-3-yl]urea Traditional Name: 1-(2-cyanophenyl)-3-[2-(4-iodophenyl)-5-(2-thienyl)pyrazol-3-yl]urea Formula: C21H14IN5OS MolecularWeight: 511.33823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=O)NC2=CC(=NN2C3=CC=C(C=C3)I)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=O)NC2=CC(=NN2C3=CC=C(C=C3)I)C4=CC=CS4

InChI

InChI=1S/C21H14IN5OS/c22-15-7-9-16(10-8-15)27-20(12-18(26-27)19-6-3-11-29-19)25-21(28)24-17-5-2-1-4-14(17)13-23/h1-12H,(H2,24,25,28)