1-(5-tert-butyl-2-methoxy-phenyl)-3-(4-pyridin-4-ylsulfanylphenyl)urea

Systemtic Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-(4-pyridin-4-ylsulfanylphenyl)urea Openeye Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-(4-pyridylsulfanyl)phenyl]urea CAS Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-[4-(pyridin-4-ylthio)phenyl]urea IUPAC Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-(4-pyridin-4-ylsulfanylphenyl)urea Traditional Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-(4-pyridylthio)phenyl]urea Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)NC2=CC=C(C=C2)SC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)NC2=CC=C(C=C2)SC3=CC=NC=C3

InChI

InChI=1S/C23H25N3O2S/c1-23(2,3)16-5-10-21(28-4)20(15-16)26-22(27)25-17-6-8-18(9-7-17)29-19-11-13-24-14-12-19/h5-15H,1-4H3,(H2,25,26,27)