1-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea

Systemtic Name: 1-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea Openeye Name: 1-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea CAS Name: 1-[4-[(4-phenyl-1-piperazinyl)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea IUPAC Name: 1-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea Traditional Name: 1-[4-[(4-phenylpiperazino)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea Formula: C27H32N4O4 MolecularWeight: 476.56738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H32N4O4/c1-33-24-17-22(18-25(34-2)26(24)35-3)29-27(32)28-21-11-9-20(10-12-21)19-30-13-15-31(16-14-30)23-7-5-4-6-8-23/h4-12,17-18H,13-16,19H2,1-3H3,(H2,28,29,32)