1-(3-tert-butylphenyl)-3-[4-(3-pyridin-3-ylpropoxy)naphthalen-1-yl]urea

Systemtic Name: 1-(3-tert-butylphenyl)-3-[4-(3-pyridin-3-ylpropoxy)naphthalen-1-yl]urea Openeye Name: 1-(3-tert-butylphenyl)-3-[4-[3-(3-pyridyl)propoxy]-1-naphthyl]urea CAS Name: 1-(3-tert-butylphenyl)-3-[4-[3-(3-pyridinyl)propoxy]-1-naphthalenyl]urea IUPAC Name: 1-(3-tert-butylphenyl)-3-[4-(3-pyridin-3-ylpropoxy)naphthalen-1-yl]urea Traditional Name: 1-(3-tert-butylphenyl)-3-[4-[3-(3-pyridyl)propoxy]-1-naphthyl]urea Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C1)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCCC4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=CC=C1)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCCC4=CN=CC=C4

InChI

InChI=1S/C29H31N3O2/c1-29(2,3)22-11-6-12-23(19-22)31-28(33)32-26-15-16-27(25-14-5-4-13-24(25)26)34-18-8-10-21-9-7-17-30-20-21/h4-7,9,11-17,19-20H,8,10,18H2,1-3H3,(H2,31,32,33)