1-[1-(4-methylsulfonylphenyl)ethyl]-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]urea

Systemtic Name: 1-[1-(4-methylsulfonylphenyl)ethyl]-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]urea Openeye Name: 1-[1-(4-methylsulfonylphenyl)ethyl]-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]urea CAS Name: 1-[1-(4-methylsulfonylphenyl)ethyl]-3-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]urea IUPAC Name: 1-[1-(4-methylsulfonylphenyl)ethyl]-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]urea Traditional Name: 1-[4-(2-ketopyrrolidino)benzyl]-3-[1-(4-mesylphenyl)ethyl]urea Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)NCC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)NCC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C21H25N3O4S/c1-15(17-7-11-19(12-8-17)29(2,27)28)23-21(26)22-14-16-5-9-18(10-6-16)24-13-3-4-20(24)25/h5-12,15H,3-4,13-14H2,1-2H3,(H2,22,23,26)