1-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]urea CAS Name: 1-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]urea Traditional Name: 1-benzyl-3-[2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]urea Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)CNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)CNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O2/c26-20(16-23-21(27)22-15-18-7-3-1-4-8-18)25-13-11-24(12-14-25)17-19-9-5-2-6-10-19/h1-10H,11-17H2,(H2,22,23,27)/p+1