1-[3-(4-ethylpiperazine-1,4-diium-1-yl)propyl]-3-[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]urea

Systemtic Name: 1-[3-(4-ethylpiperazine-1,4-diium-1-yl)propyl]-3-[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]urea Openeye Name: 1-[3-(4-ethylpiperazine-1,4-diium-1-yl)propyl]-3-[(3S)-5-oxo-1-phenyl-pyrrolidin-3-yl]urea CAS Name: 1-[3-(4-ethyl-1-piperazine-1,4-diiumyl)propyl]-3-[(3S)-5-oxo-1-phenyl-3-pyrrolidinyl]urea IUPAC Name: 1-[3-(4-ethylpiperazine-1,4-diium-1-yl)propyl]-3-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]urea Traditional Name: 1-[3-(4-ethylpiperazine-1,4-diium-1-yl)propyl]-3-[(3S)-5-keto-1-phenyl-pyrrolidin-3-yl]urea Formula: C20H33N5O2+2 MolecularWeight: 375.50832

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCCNC(=O)NC2CC(=O)N(C2)C3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCCNC(=O)N[C@H]2CC(=O)N(C2)C3=CC=CC=C3

InChI

InChI=1S/C20H31N5O2/c1-2-23-11-13-24(14-12-23)10-6-9-21-20(27)22-17-15-19(26)25(16-17)18-7-4-3-5-8-18/h3-5,7-8,17H,2,6,9-16H2,1H3,(H2,21,22,27)/p+2/t17-/m0/s1