1-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]carbonylphenyl]urea

Systemtic Name: 1-[3-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]carbonylphenyl]urea Openeye Name: [3-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]urea CAS Name: [3-[[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]urea IUPAC Name: [3-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]urea Traditional Name: [3-[4-(2,5-dimethoxybenzyl)piperazine-1-carbonyl]phenyl]urea Formula: C21H26N4O4 MolecularWeight: 398.45554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)N

InChI

InChI=1S/C21H26N4O4/c1-28-18-6-7-19(29-2)16(13-18)14-24-8-10-25(11-9-24)20(26)15-4-3-5-17(12-15)23-21(22)27/h3-7,12-13H,8-11,14H2,1-2H3,(H3,22,23,27)