1-[5-tert-butyl-3-(2,2-dimethyl-3-oxidanylidene-piperazin-1-yl)carbonyl-furan-2-yl]-3-(4-methyl-3-pyridin-4-yl-phenyl)urea

Systemtic Name: 1-[5-tert-butyl-3-(2,2-dimethyl-3-oxidanylidene-piperazin-1-yl)carbonyl-furan-2-yl]-3-(4-methyl-3-pyridin-4-yl-phenyl)urea Openeye Name: 1-[5-tert-butyl-3-(2,2-dimethyl-3-oxo-piperazine-1-carbonyl)-2-furyl]-3-[4-methyl-3-(4-pyridyl)phenyl]urea CAS Name: 1-[5-tert-butyl-3-[(2,2-dimethyl-3-oxo-1-piperazinyl)-oxomethyl]-2-furanyl]-3-(4-methyl-3-pyridin-4-ylphenyl)urea IUPAC Name: 1-[5-tert-butyl-3-(2,2-dimethyl-3-oxopiperazine-1-carbonyl)furan-2-yl]-3-(4-methyl-3-pyridin-4-ylphenyl)urea Traditional Name: 1-[5-tert-butyl-3-(3-keto-2,2-dimethyl-piperazine-1-carbonyl)-2-furyl]-3-[4-methyl-3-(4-pyridyl)phenyl]urea Formula: C28H33N5O4 MolecularWeight: 503.59272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=C(C=C(O2)C(C)(C)C)C(=O)N3CCNC(=O)C3(C)C)C4=CC=NC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=C(C=C(O2)C(C)(C)C)C(=O)N3CCNC(=O)C3(C)C)C4=CC=NC=C4

InChI

InChI=1S/C28H33N5O4/c1-17-7-8-19(15-20(17)18-9-11-29-12-10-18)31-26(36)32-23-21(16-22(37-23)27(2,3)4)24(34)33-14-13-30-25(35)28(33,5)6/h7-12,15-16H,13-14H2,1-6H3,(H,30,35)(H2,31,32,36)