4-[(2-fluoranyl-4-methyl-phenyl)amino]-7-methoxy-6-[4-(2-methylsulfonylethyl)piperazin-1-yl]cinnoline-3-carboxamide

Systemtic Name: 4-[(2-fluoranyl-4-methyl-phenyl)amino]-7-methoxy-6-[4-(2-methylsulfonylethyl)piperazin-1-yl]cinnoline-3-carboxamide Openeye Name: 4-(2-fluoro-4-methyl-anilino)-7-methoxy-6-[4-(2-methylsulfonylethyl)piperazin-1-yl]cinnoline-3-carboxamide CAS Name: 4-(2-fluoro-4-methylanilino)-7-methoxy-6-[4-(2-methylsulfonylethyl)-1-piperazinyl]-3-cinnolinecarboxamide IUPAC Name: 4-(2-fluoro-4-methylanilino)-7-methoxy-6-[4-(2-methylsulfonylethyl)piperazin-1-yl]cinnoline-3-carboxamide Traditional Name: 4-(2-fluoro-4-methyl-anilino)-6-[4-(2-mesylethyl)piperazino]-7-methoxy-cinnoline-3-carboxamide Formula: C24H29FN6O4S MolecularWeight: 516.588263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(N=NC3=CC(=C(C=C32)N4CCN(CC4)CCS(=O)(=O)C)OC)C(=O)N)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(N=NC3=CC(=C(C=C32)N4CCN(CC4)CCS(=O)(=O)C)OC)C(=O)N)F

InChI

InChI=1S/C24H29FN6O4S/c1-15-4-5-18(17(25)12-15)27-22-16-13-20(21(35-2)14-19(16)28-29-23(22)24(26)32)31-8-6-30(7-9-31)10-11-36(3,33)34/h4-5,12-14H,6-11H2,1-3H3,(H2,26,32)(H,27,28)