6-[2-[[5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinolin-7-yl]amino]ethylamino]pyridine-3-carbonitrile

Systemtic Name: 6-[2-[[5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinolin-7-yl]amino]ethylamino]pyridine-3-carbonitrile Openeye Name: 6-[2-[(5-amino-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolyl)amino]ethylamino]pyridine-3-carbonitrile CAS Name: 6-[2-[(5-amino-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolinyl)amino]ethylamino]-3-pyridinecarbonitrile IUPAC Name: 6-[2-[(5-amino-1-cyclopropyl-6,8-difluoro-4-oxoquinolin-7-yl)amino]ethylamino]pyridine-3-carbonitrile Traditional Name: 6-[2-[(5-amino-1-cyclopropyl-6,8-difluoro-4-keto-7-quinolyl)amino]ethylamino]nicotinonitrile Formula: C20H18F2N6O MolecularWeight: 396.393326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=CC(=O)C3=C2C(=C(C(=C3N)F)NCCNC4=NC=C(C=C4)C#N)F

Isomeric SMILES

C1CC1N2C=CC(=O)C3=C2C(=C(C(=C3N)F)NCCNC4=NC=C(C=C4)C#N)F

InChI

InChI=1S/C20H18F2N6O/c21-16-18(24)15-13(29)5-8-28(12-2-3-12)20(15)17(22)19(16)26-7-6-25-14-4-1-11(9-23)10-27-14/h1,4-5,8,10,12,26H,2-3,6-7,24H2,(H,25,27)