3-azanyl-3-[1-[3-azanyl-1-cyclopropyl-6-fluoranyl-8-methyl-2,4-bis(oxidanylidene)quinazolin-7-yl]pyrrolidin-3-yl]-2,2-dimethyl-propanenitrile

Systemtic Name: 3-azanyl-3-[1-[3-azanyl-1-cyclopropyl-6-fluoranyl-8-methyl-2,4-bis(oxidanylidene)quinazolin-7-yl]pyrrolidin-3-yl]-2,2-dimethyl-propanenitrile Openeye Name: 3-amino-3-[1-(3-amino-1-cyclopropyl-6-fluoro-8-methyl-2,4-dioxo-quinazolin-7-yl)pyrrolidin-3-yl]-2,2-dimethyl-propanenitrile CAS Name: 3-amino-3-[1-(3-amino-1-cyclopropyl-6-fluoro-8-methyl-2,4-dioxo-7-quinazolinyl)-3-pyrrolidinyl]-2,2-dimethylpropanenitrile IUPAC Name: 3-amino-3-[1-(3-amino-1-cyclopropyl-6-fluoro-8-methyl-2,4-dioxoquinazolin-7-yl)pyrrolidin-3-yl]-2,2-dimethylpropanenitrile Traditional Name: 3-amino-3-[1-(3-amino-1-cyclopropyl-6-fluoro-2,4-diketo-8-methyl-quinazolin-7-yl)pyrrolidin-3-yl]-2,2-dimethyl-propionitrile Formula: C21H27FN6O2 MolecularWeight: 414.476483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCC(C3)C(C(C)(C)C#N)N)F)C(=O)N(C(=O)N2C4CC4)N

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCC(C3)C(C(C)(C)C#N)N)F)C(=O)N(C(=O)N2C4CC4)N

InChI

InChI=1S/C21H27FN6O2/c1-11-16-14(19(29)28(25)20(30)27(16)13-4-5-13)8-15(22)17(11)26-7-6-12(9-26)18(24)21(2,3)10-23/h8,12-13,18H,4-7,9,24-25H2,1-3H3