1-[[4-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]carbonylphenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]carbonylphenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-[[4-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazine-1-carbonyl]phenyl]methyl]-3-isopropyl-urea CAS Name: 1-[[4-[[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazine-1-carbonyl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-[4-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazine-1-carbonyl]benzyl]-3-isopropyl-urea Formula: C22H26ClFN4O4S MolecularWeight: 496.982643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C22H26ClFN4O4S/c1-15(2)26-22(30)25-14-16-3-5-17(6-4-16)21(29)27-9-11-28(12-10-27)33(31,32)18-7-8-20(24)19(23)13-18/h3-8,13,15H,9-12,14H2,1-2H3,(H2,25,26,30)