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

Systemtic Name: 1-(4-pentoxyphenyl)-3-(4-pyridin-3-ylphenyl)thiourea Openeye Name: 1-(4-pentoxyphenyl)-3-[4-(3-pyridyl)phenyl]thiourea CAS Name: 1-(4-pentoxyphenyl)-3-[4-(3-pyridinyl)phenyl]thiourea IUPAC Name: 1-(4-pentoxyphenyl)-3-(4-pyridin-3-ylphenyl)thiourea Traditional Name: 1-(4-amoxyphenyl)-3-[4-(3-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=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3OS/c1-2-3-4-16-27-22-13-11-21(12-14-22)26-23(28)25-20-9-7-18(8-10-20)19-6-5-15-24-17-19/h5-15,17H,2-4,16H2,1H3,(H2,25,26,28)