1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(4-phenylpiperazin-1-yl)ethyl]urea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(4-phenylpiperazin-1-yl)ethyl]urea Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(4-phenylpiperazin-1-yl)ethyl]urea CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(4-phenyl-1-piperazinyl)ethyl]urea IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(4-phenylpiperazin-1-yl)ethyl]urea Traditional Name: 1-[2-(4-phenylpiperazino)ethyl]-3-veratryl-urea Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)NCCN2CCN(CC2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)NCCN2CCN(CC2)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H30N4O3/c1-28-20-9-8-18(16-21(20)29-2)17-24-22(27)23-10-11-25-12-14-26(15-13-25)19-6-4-3-5-7-19/h3-9,16H,10-15,17H2,1-2H3,(H2,23,24,27)