4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-6-methylsulfonyl-cinnoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-6-methylsulfonyl-cinnoline-3-carboxamide Openeye Name: 4-(3-chloro-2-fluoro-anilino)-6-methylsulfonyl-cinnoline-3-carboxamide CAS Name: 4-(3-chloro-2-fluoroanilino)-6-methylsulfonyl-3-cinnolinecarboxamide IUPAC Name: 4-(3-chloro-2-fluoroanilino)-6-methylsulfonylcinnoline-3-carboxamide Traditional Name: 4-(3-chloro-2-fluoro-anilino)-6-mesyl-cinnoline-3-carboxamide Formula: C16H12ClFN4O3S MolecularWeight: 394.807883

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=NC(=C2NC3=C(C(=CC=C3)Cl)F)C(=O)N

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=NC(=C2NC3=C(C(=CC=C3)Cl)F)C(=O)N

InChI

InChI=1S/C16H12ClFN4O3S/c1-26(24,25)8-5-6-11-9(7-8)14(15(16(19)23)22-21-11)20-12-4-2-3-10(17)13(12)18/h2-7H,1H3,(H2,19,23)(H,20,21)