5-azanyl-7-[(3R,4R)-3-[(1R)-1-azanyl-3-methoxy-propyl]-4-fluoranyl-pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-quinazoline-2,4-dione

Systemtic Name: 5-azanyl-7-[(3R,4R)-3-[(1R)-1-azanyl-3-methoxy-propyl]-4-fluoranyl-pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-quinazoline-2,4-dione Openeye Name: 5-amino-7-[(3R,4R)-3-[(1R)-1-amino-3-methoxy-propyl]-4-fluoro-pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-quinazoline-2,4-dione CAS Name: 5-amino-7-[(3R,4R)-3-[(1R)-1-amino-3-methoxypropyl]-4-fluoro-1-pyrrolidinyl]-1-cyclopropyl-8-methoxyquinazoline-2,4-dione IUPAC Name: 5-amino-7-[(3R,4R)-3-[(1R)-1-amino-3-methoxypropyl]-4-fluoropyrrolidin-1-yl]-1-cyclopropyl-8-methoxyquinazoline-2,4-dione Traditional Name: 5-amino-7-[(3R,4R)-3-[(1R)-1-amino-3-methoxy-propyl]-4-fluoro-pyrrolidino]-1-cyclopropyl-8-methoxy-quinazoline-2,4-quinone Formula: C20H28FN5O4 MolecularWeight: 421.465823

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(C1CN(CC1F)C2=CC(=C3C(=C2OC)N(C(=O)NC3=O)C4CC4)N)N

Isomeric SMILES

COCC[C@H]([C@H]1CN(C[C@@H]1F)C2=CC(=C3C(=C2OC)N(C(=O)NC3=O)C4CC4)N)N

InChI

InChI=1S/C20H28FN5O4/c1-29-6-5-13(22)11-8-25(9-12(11)21)15-7-14(23)16-17(18(15)30-2)26(10-3-4-10)20(28)24-19(16)27/h7,10-13H,3-6,8-9,22-23H2,1-2H3,(H,24,27,28)/t11-,12-,13+/m0/s1