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

Systemtic Name: N-(3-azanylpropyl)-4-fluoranyl-3-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]methylamino]benzamide Openeye Name: N-(3-aminopropyl)-4-fluoro-3-[[2-(2-pyridylamino)thiazol-5-yl]methylamino]benzamide CAS Name: N-(3-aminopropyl)-4-fluoro-3-[[2-(2-pyridinylamino)-5-thiazolyl]methylamino]benzamide IUPAC Name: N-(3-aminopropyl)-4-fluoro-3-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]methylamino]benzamide Traditional Name: N-(3-aminopropyl)-4-fluoro-3-[[2-(2-pyridylamino)thiazol-5-yl]methylamino]benzamide Formula: C19H21FN6OS MolecularWeight: 400.473043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC2=NC=C(S2)CNC3=C(C=CC(=C3)C(=O)NCCCN)F

Isomeric SMILES

C1=CC=NC(=C1)NC2=NC=C(S2)CNC3=C(C=CC(=C3)C(=O)NCCCN)F

InChI

InChI=1S/C19H21FN6OS/c20-15-6-5-13(18(27)23-9-3-7-21)10-16(15)24-11-14-12-25-19(28-14)26-17-4-1-2-8-22-17/h1-2,4-6,8,10,12,24H,3,7,9,11,21H2,(H,23,27)(H,22,25,26)