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

Systemtic Name: 7-[4-(aminomethyl)-3,3-bis(fluoranyl)pyrrolidin-1-yl]-3-azanyl-1-cyclopropyl-8-methoxy-quinazoline-2,4-dione Openeye Name: 3-amino-7-[4-(aminomethyl)-3,3-difluoro-pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-quinazoline-2,4-dione CAS Name: 3-amino-7-[4-(aminomethyl)-3,3-difluoro-1-pyrrolidinyl]-1-cyclopropyl-8-methoxyquinazoline-2,4-dione IUPAC Name: 3-amino-7-[4-(aminomethyl)-3,3-difluoropyrrolidin-1-yl]-1-cyclopropyl-8-methoxyquinazoline-2,4-dione Traditional Name: 3-amino-7-[4-(aminomethyl)-3,3-difluoro-pyrrolidino]-1-cyclopropyl-8-methoxy-quinazoline-2,4-quinone Formula: C17H21F2N5O3 MolecularWeight: 381.377146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1N(C(=O)N(C2=O)N)C3CC3)N4CC(C(C4)(F)F)CN

Isomeric SMILES

COC1=C(C=CC2=C1N(C(=O)N(C2=O)N)C3CC3)N4CC(C(C4)(F)F)CN

InChI

InChI=1S/C17H21F2N5O3/c1-27-14-12(22-7-9(6-20)17(18,19)8-22)5-4-11-13(14)23(10-2-3-10)16(26)24(21)15(11)25/h4-5,9-10H,2-3,6-8,20-21H2,1H3