N-(3-azanylpropyl)-N-[1-[5-[(4-fluorophenyl)methyl]-3-methyl-4-oxidanylidene-[1,2]oxazolo[5,4-d]pyrimidin-6-yl]propyl]-4-methyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[5-[(4-fluorophenyl)methyl]-3-methyl-4-oxidanylidene-[1,2]oxazolo[5,4-d]pyrimidin-6-yl]propyl]-4-methyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[1-[5-[(4-fluorophenyl)methyl]-3-methyl-4-oxo-isoxazolo[5,4-d]pyrimidin-6-yl]propyl]-4-methyl-benzamide CAS Name: N-(3-aminopropyl)-N-[1-[5-[(4-fluorophenyl)methyl]-3-methyl-4-oxo-6-isoxazolo[5,4-d]pyrimidinyl]propyl]-4-methylbenzamide IUPAC Name: N-(3-aminopropyl)-N-[1-[5-[(4-fluorophenyl)methyl]-3-methyl-4-oxo-[1,2]oxazolo[5,4-d]pyrimidin-6-yl]propyl]-4-methylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-[5-(4-fluorobenzyl)-4-keto-3-methyl-isoxazolo[5,4-d]pyrimidin-6-yl]propyl]-4-methyl-benzamide Formula: C27H30FN5O3 MolecularWeight: 491.557203

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C(=NO2)C)C(=O)N1CC3=CC=C(C=C3)F)N(CCCN)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C1=NC2=C(C(=NO2)C)C(=O)N1CC3=CC=C(C=C3)F)N(CCCN)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H30FN5O3/c1-4-22(32(15-5-14-29)26(34)20-10-6-17(2)7-11-20)24-30-25-23(18(3)31-36-25)27(35)33(24)16-19-8-12-21(28)13-9-19/h6-13,22H,4-5,14-16,29H2,1-3H3