3-azanyl-7-(3-azanylpyrrolidin-1-yl)-1-butan-2-yl-8-chloranyl-6-fluoranyl-quinazoline-2,4-dione

Systemtic Name: 3-azanyl-7-(3-azanylpyrrolidin-1-yl)-1-butan-2-yl-8-chloranyl-6-fluoranyl-quinazoline-2,4-dione Openeye Name: 3-amino-7-(3-aminopyrrolidin-1-yl)-8-chloro-6-fluoro-1-sec-butyl-quinazoline-2,4-dione CAS Name: 3-amino-7-(3-amino-1-pyrrolidinyl)-1-butan-2-yl-8-chloro-6-fluoroquinazoline-2,4-dione IUPAC Name: 3-amino-7-(3-aminopyrrolidin-1-yl)-1-butan-2-yl-8-chloro-6-fluoroquinazoline-2,4-dione Traditional Name: 3-amino-7-(3-aminopyrrolidino)-8-chloro-6-fluoro-1-sec-butyl-quinazoline-2,4-quinone Formula: C16H21ClFN5O2 MolecularWeight: 369.821643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C(=C(C=C2C(=O)N(C1=O)N)F)N3CCC(C3)N)Cl

Isomeric SMILES

CCC(C)N1C2=C(C(=C(C=C2C(=O)N(C1=O)N)F)N3CCC(C3)N)Cl

InChI

InChI=1S/C16H21ClFN5O2/c1-3-8(2)22-13-10(15(24)23(20)16(22)25)6-11(18)14(12(13)17)21-5-4-9(19)7-21/h6,8-9H,3-5,7,19-20H2,1-2H3