1-(4-pentoxy-2-phenyl-phenyl)-3-(2-phenylpyrazol-3-yl)thiourea

Systemtic Name: 1-(4-pentoxy-2-phenyl-phenyl)-3-(2-phenylpyrazol-3-yl)thiourea Openeye Name: 1-(4-pentoxy-2-phenyl-phenyl)-3-(2-phenylpyrazol-3-yl)thiourea CAS Name: 1-(4-pentoxy-2-phenylphenyl)-3-(2-phenyl-3-pyrazolyl)thiourea IUPAC Name: 1-(4-pentoxy-2-phenylphenyl)-3-(2-phenylpyrazol-3-yl)thiourea Traditional Name: 1-(4-amoxy-2-phenyl-phenyl)-3-(2-phenylpyrazol-3-yl)thiourea Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC(=C(C=C1)NC(=S)NC2=CC=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCOC1=CC(=C(C=C1)NC(=S)NC2=CC=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4OS/c1-2-3-10-19-32-23-15-16-25(24(20-23)21-11-6-4-7-12-21)29-27(33)30-26-17-18-28-31(26)22-13-8-5-9-14-22/h4-9,11-18,20H,2-3,10,19H2,1H3,(H2,29,30,33)