8-cyano-4-[3-[4-(4-fluoranyl-2-methoxy-phenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-quinoline-3-carboxamide

Systemtic Name: 8-cyano-4-[3-[4-(4-fluoranyl-2-methoxy-phenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-quinoline-3-carboxamide Openeye Name: 8-cyano-4-[3-[4-(4-fluoro-2-methoxy-phenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-quinoline-3-carboxamide CAS Name: 8-cyano-4-[3-[4-(4-fluoro-2-methoxyphenyl)-1-piperazinyl]propylamino]-N,N-dimethyl-3-quinolinecarboxamide IUPAC Name: 8-cyano-4-[3-[4-(4-fluoro-2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethylquinoline-3-carboxamide Traditional Name: 8-cyano-4-[3-[4-(4-fluoro-2-methoxy-phenyl)piperazino]propylamino]-N,N-dimethyl-quinoline-3-carboxamide Formula: C27H31FN6O2 MolecularWeight: 490.572443

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=C(C2=CC=CC(=C2N=C1)C#N)NCCCN3CCN(CC3)C4=C(C=C(C=C4)F)OC

Isomeric SMILES

CN(C)C(=O)C1=C(C2=CC=CC(=C2N=C1)C#N)NCCCN3CCN(CC3)C4=C(C=C(C=C4)F)OC

InChI

InChI=1S/C27H31FN6O2/c1-32(2)27(35)22-18-31-25-19(17-29)6-4-7-21(25)26(22)30-10-5-11-33-12-14-34(15-13-33)23-9-8-20(28)16-24(23)36-3/h4,6-9,16,18H,5,10-15H2,1-3H3,(H,30,31)