1-[(2R)-1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-phenyl-urea

Systemtic Name: 1-[(2R)-1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-phenyl-urea Openeye Name: 1-[(1R)-1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-carbonyl]-2-methyl-propyl]-3-phenyl-urea CAS Name: 1-[(2R)-1-[4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]-3-methyl-1-oxobutan-2-yl]-3-phenylurea IUPAC Name: 1-[(2R)-1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-methyl-1-oxobutan-2-yl]-3-phenylurea Traditional Name: 1-[(1R)-1-[4-(3-chlorobenzyl)piperazin-4-ium-1-carbonyl]-2-methyl-propyl]-3-phenyl-urea Formula: C23H30ClN4O2+ MolecularWeight: 429.9629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC[NH+](CC1)CC2=CC(=CC=C2)Cl)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@H](C(=O)N1CC[NH+](CC1)CC2=CC(=CC=C2)Cl)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H29ClN4O2/c1-17(2)21(26-23(30)25-20-9-4-3-5-10-20)22(29)28-13-11-27(12-14-28)16-18-7-6-8-19(24)15-18/h3-10,15,17,21H,11-14,16H2,1-2H3,(H2,25,26,30)/p+1/t21-/m1/s1