1-(4-pentoxyphenyl)-3-(4-pyridin-2-ylphenyl)thiourea

Systemtic Name: 1-(4-pentoxyphenyl)-3-(4-pyridin-2-ylphenyl)thiourea Openeye Name: 1-(4-pentoxyphenyl)-3-[4-(2-pyridyl)phenyl]thiourea CAS Name: 1-(4-pentoxyphenyl)-3-[4-(2-pyridinyl)phenyl]thiourea IUPAC Name: 1-(4-pentoxyphenyl)-3-(4-pyridin-2-ylphenyl)thiourea Traditional Name: 1-(4-amoxyphenyl)-3-[4-(2-pyridyl)phenyl]thiourea Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=CC=CC=N3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=CC=CC=N3

InChI

InChI=1S/C23H25N3OS/c1-2-3-6-17-27-21-14-12-20(13-15-21)26-23(28)25-19-10-8-18(9-11-19)22-7-4-5-16-24-22/h4-5,7-16H,2-3,6,17H2,1H3,(H2,25,26,28)