1-[(2S,3S)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-pentan-2-yl]urea

Systemtic Name: 1-[(2S,3S)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-pentan-2-yl]urea Openeye Name: [(1S,2S)-1-[4-(2-fluorophenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-butyl]urea CAS Name: [(2S,3S)-1-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-3-methyl-1-oxopentan-2-yl]urea IUPAC Name: [(2S,3S)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl]urea Traditional Name: [(1S,2S)-1-[4-(2-fluorophenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-butyl]urea Formula: C17H25FN4O4S MolecularWeight: 400.468203

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2F)NC(=O)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2F)NC(=O)N

InChI

InChI=1S/C17H25FN4O4S/c1-3-12(2)15(20-17(19)24)16(23)21-8-10-22(11-9-21)27(25,26)14-7-5-4-6-13(14)18/h4-7,12,15H,3,8-11H2,1-2H3,(H3,19,20,24)/t12-,15-/m0/s1