1-phenyl-3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoylamino]urea

Systemtic Name: 1-phenyl-3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoylamino]urea Openeye Name: 1-[3-(4-benzylpiperazin-1-yl)propanoylamino]-3-phenyl-urea CAS Name: 1-[[1-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]amino]-3-phenylurea IUPAC Name: 1-[3-(4-benzylpiperazin-1-yl)propanoylamino]-3-phenylurea Traditional Name: 1-[3-(4-benzylpiperazino)propanoylamino]-3-phenyl-urea Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NNC(=O)NC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCC(=O)NNC(=O)NC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N5O2/c27-20(23-24-21(28)22-19-9-5-2-6-10-19)11-12-25-13-15-26(16-14-25)17-18-7-3-1-4-8-18/h1-10H,11-17H2,(H,23,27)(H2,22,24,28)