1-[5-tert-butyl-2-(2,5-dimethylpyrrol-1-yl)phenyl]-3-(4-pyridin-4-yloxyphenyl)urea

Systemtic Name: 1-[5-tert-butyl-2-(2,5-dimethylpyrrol-1-yl)phenyl]-3-(4-pyridin-4-yloxyphenyl)urea Openeye Name: 1-[5-tert-butyl-2-(2,5-dimethylpyrrol-1-yl)phenyl]-3-[4-(4-pyridyloxy)phenyl]urea CAS Name: 1-[5-tert-butyl-2-(2,5-dimethyl-1-pyrrolyl)phenyl]-3-(4-pyridin-4-yloxyphenyl)urea IUPAC Name: 1-[5-tert-butyl-2-(2,5-dimethylpyrrol-1-yl)phenyl]-3-(4-pyridin-4-yloxyphenyl)urea Traditional Name: 1-[5-tert-butyl-2-(2,5-dimethylpyrrol-1-yl)phenyl]-3-[4-(4-pyridyloxy)phenyl]urea Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=C(C=C2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)OC4=CC=NC=C4)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C=C(C=C2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)OC4=CC=NC=C4)C

InChI

InChI=1S/C28H30N4O2/c1-19-6-7-20(2)32(19)26-13-8-21(28(3,4)5)18-25(26)31-27(33)30-22-9-11-23(12-10-22)34-24-14-16-29-17-15-24/h6-18H,1-5H3,(H2,30,31,33)