N-[1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide

Systemtic Name: N-[1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide Openeye Name: N-[1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-propyl]-2-methyl-benzamide CAS Name: N-[1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide IUPAC Name: N-[1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide Traditional Name: N-[1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-propyl]-2-methyl-benzamide Formula: C23H27ClFN3O4S MolecularWeight: 495.994583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C23H27ClFN3O4S/c1-15(2)21(26-22(29)18-7-5-4-6-16(18)3)23(30)27-10-12-28(13-11-27)33(31,32)17-8-9-20(25)19(24)14-17/h4-9,14-15,21H,10-13H2,1-3H3,(H,26,29)