1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(3-ethylphenyl)urea

Systemtic Name: 1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(3-ethylphenyl)urea Openeye Name: 1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(3-ethylphenyl)urea CAS Name: 1-[4-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]phenyl]-3-(3-ethylphenyl)urea IUPAC Name: 1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(3-ethylphenyl)urea Traditional Name: 1-[4-[4-(2-ethylbutanoyl)piperazino]phenyl]-3-(3-ethylphenyl)urea Formula: C25H34N4O2 MolecularWeight: 422.56306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C(CC)CC

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C(CC)CC

InChI

InChI=1S/C25H34N4O2/c1-4-19-8-7-9-22(18-19)27-25(31)26-21-10-12-23(13-11-21)28-14-16-29(17-15-28)24(30)20(5-2)6-3/h7-13,18,20H,4-6,14-17H2,1-3H3,(H2,26,27,31)