1-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-3-(3-methylphenyl)urea Openeye Name: 1-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-3-(m-tolyl)urea CAS Name: 1-[2-(4-dimethylaminophenyl)-2-(4-phenyl-1-piperazinyl)ethyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-3-(3-methylphenyl)urea Traditional Name: 1-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazino)ethyl]-3-(m-tolyl)urea Formula: C28H35N5O MolecularWeight: 457.6104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C28H35N5O/c1-22-8-7-9-24(20-22)30-28(34)29-21-27(23-12-14-25(15-13-23)31(2)3)33-18-16-32(17-19-33)26-10-5-4-6-11-26/h4-15,20,27H,16-19,21H2,1-3H3,(H2,29,30,34)