2-chloranyl-N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 2-chloro-N-[2-(3-fluoroanilino)-2-oxo-ethyl]-N-methyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: 2-chloro-N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-5-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-5-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: 2-chloro-N-[2-(3-fluoroanilino)-2-keto-ethyl]-N-methyl-5-(4-phenylpiperazino)sulfonyl-benzamide Formula: C26H26ClFN4O4S MolecularWeight: 545.025443

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC=C1)F)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)Cl

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC=C1)F)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C26H26ClFN4O4S/c1-30(18-25(33)29-20-7-5-6-19(28)16-20)26(34)23-17-22(10-11-24(23)27)37(35,36)32-14-12-31(13-15-32)21-8-3-2-4-9-21/h2-11,16-17H,12-15,18H2,1H3,(H,29,33)