3-azanyl-4-chloranyl-N-[2-[4-(4-fluoranyl-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-naphthalen-1-yl-benzamide

Systemtic Name: 3-azanyl-4-chloranyl-N-[2-[4-(4-fluoranyl-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-naphthalen-1-yl-benzamide Openeye Name: 3-amino-4-chloro-N-[2-[4-(4-fluoro-2-methylsulfonyl-phenyl)piperazin-1-yl]-2-oxo-ethyl]-N-(1-naphthyl)benzamide CAS Name: 3-amino-4-chloro-N-[2-[4-(4-fluoro-2-methylsulfonylphenyl)-1-piperazinyl]-2-oxoethyl]-N-(1-naphthalenyl)benzamide IUPAC Name: 3-amino-4-chloro-N-[2-[4-(4-fluoro-2-methylsulfonylphenyl)piperazin-1-yl]-2-oxoethyl]-N-naphthalen-1-ylbenzamide Traditional Name: 3-amino-4-chloro-N-[2-[4-(4-fluoro-2-mesyl-phenyl)piperazino]-2-keto-ethyl]-N-(1-naphthyl)benzamide Formula: C30H28ClFN4O4S MolecularWeight: 595.084123

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)F)N2CCN(CC2)C(=O)CN(C3=CC=CC4=CC=CC=C43)C(=O)C5=CC(=C(C=C5)Cl)N

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)F)N2CCN(CC2)C(=O)CN(C3=CC=CC4=CC=CC=C43)C(=O)C5=CC(=C(C=C5)Cl)N

InChI

InChI=1S/C30H28ClFN4O4S/c1-41(39,40)28-18-22(32)10-12-27(28)34-13-15-35(16-14-34)29(37)19-36(30(38)21-9-11-24(31)25(33)17-21)26-8-4-6-20-5-2-3-7-23(20)26/h2-12,17-18H,13-16,19,33H2,1H3