3-azanyl-7-[(3R,4S)-3-(2-azanylpropan-2-yl)-4-fluoranyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methyl-quinazoline-2,4-dione

Systemtic Name: 3-azanyl-7-[(3R,4S)-3-(2-azanylpropan-2-yl)-4-fluoranyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methyl-quinazoline-2,4-dione Openeye Name: 3-amino-7-[(3R,4S)-3-(1-amino-1-methyl-ethyl)-4-fluoro-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methyl-quinazoline-2,4-dione CAS Name: 3-amino-7-[(3R,4S)-3-(2-aminopropan-2-yl)-4-fluoro-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methylquinazoline-2,4-dione IUPAC Name: 3-amino-7-[(3R,4S)-3-(2-aminopropan-2-yl)-4-fluoropyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methylquinazoline-2,4-dione Traditional Name: 3-amino-7-[(3R,4S)-3-(1-amino-1-methyl-ethyl)-4-fluoro-pyrrolidino]-1-cyclopropyl-6-fluoro-8-methyl-quinazoline-2,4-quinone Formula: C19H25F2N5O2 MolecularWeight: 393.430906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CC(C(C3)F)C(C)(C)N)F)C(=O)N(C(=O)N2C4CC4)N

Isomeric SMILES

CC1=C2C(=CC(=C1N3C[C@@H]([C@@H](C3)F)C(C)(C)N)F)C(=O)N(C(=O)N2C4CC4)N

InChI

InChI=1S/C19H25F2N5O2/c1-9-15-11(17(27)26(23)18(28)25(15)10-4-5-10)6-13(20)16(9)24-7-12(14(21)8-24)19(2,3)22/h6,10,12,14H,4-5,7-8,22-23H2,1-3H3/t12-,14+/m0/s1