[4-fluoranyl-3-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]methylamino]phenyl]-piperazin-1-yl-methanone

Systemtic Name: [4-fluoranyl-3-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]methylamino]phenyl]-piperazin-1-yl-methanone Openeye Name: [4-fluoro-3-[[2-(2-pyridylamino)thiazol-5-yl]methylamino]phenyl]-piperazin-1-yl-methanone CAS Name: [4-fluoro-3-[[2-(2-pyridinylamino)-5-thiazolyl]methylamino]phenyl]-(1-piperazinyl)methanone IUPAC Name: [4-fluoro-3-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]methylamino]phenyl]-piperazin-1-ylmethanone Traditional Name: [4-fluoro-3-[[2-(2-pyridylamino)thiazol-5-yl]methylamino]phenyl]-piperazino-methanone Formula: C20H21FN6OS MolecularWeight: 412.483743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)F)NCC3=CN=C(S3)NC4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)F)NCC3=CN=C(S3)NC4=CC=CC=N4

InChI

InChI=1S/C20H21FN6OS/c21-16-5-4-14(19(28)27-9-7-22-8-10-27)11-17(16)24-12-15-13-25-20(29-15)26-18-3-1-2-6-23-18/h1-6,11,13,22,24H,7-10,12H2,(H,23,25,26)