4-fluoranyl-3-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]methylamino]-N-(3-pyrrolidin-1-ylpropyl)benzamide

Systemtic Name: 4-fluoranyl-3-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]methylamino]-N-(3-pyrrolidin-1-ylpropyl)benzamide Openeye Name: 4-fluoro-3-[[2-(2-pyridylamino)thiazol-5-yl]methylamino]-N-(3-pyrrolidin-1-ylpropyl)benzamide CAS Name: 4-fluoro-3-[[2-(2-pyridinylamino)-5-thiazolyl]methylamino]-N-[3-(1-pyrrolidinyl)propyl]benzamide IUPAC Name: 4-fluoro-3-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]methylamino]-N-(3-pyrrolidin-1-ylpropyl)benzamide Traditional Name: 4-fluoro-3-[[2-(2-pyridylamino)thiazol-5-yl]methylamino]-N-(3-pyrrolidinopropyl)benzamide Formula: C23H27FN6OS MolecularWeight: 454.563483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC(=O)C2=CC(=C(C=C2)F)NCC3=CN=C(S3)NC4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)CCCNC(=O)C2=CC(=C(C=C2)F)NCC3=CN=C(S3)NC4=CC=CC=N4

InChI

InChI=1S/C23H27FN6OS/c24-19-8-7-17(22(31)26-10-5-13-30-11-3-4-12-30)14-20(19)27-15-18-16-28-23(32-18)29-21-6-1-2-9-25-21/h1-2,6-9,14,16,27H,3-5,10-13,15H2,(H,26,31)(H,25,28,29)