1-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3-(2-ethoxyphenyl)urea

Systemtic Name: 1-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3-(2-ethoxyphenyl)urea Openeye Name: 1-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3-(2-ethoxyphenyl)urea CAS Name: 1-[4-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazinyl]phenyl]-3-(2-ethoxyphenyl)urea IUPAC Name: 1-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3-(2-ethoxyphenyl)urea Traditional Name: 1-[4-[4-(3,3-dimethylbutanoyl)piperazino]phenyl]-3-o-phenetyl-urea Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC(C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC(C)(C)C

InChI

InChI=1S/C25H34N4O3/c1-5-32-22-9-7-6-8-21(22)27-24(31)26-19-10-12-20(13-11-19)28-14-16-29(17-15-28)23(30)18-25(2,3)4/h6-13H,5,14-18H2,1-4H3,(H2,26,27,31)