2-(2,3-dihydro-1H-inden-5-ylamino)-4-oxidanyl-5-(4-phenoxybutyl)-1H-pyrimidin-6-one

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylamino)-4-oxidanyl-5-(4-phenoxybutyl)-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-2-(indan-5-ylamino)-5-(4-phenoxybutyl)-1H-pyrimidin-6-one CAS Name: 2-(2,3-dihydro-1H-inden-5-ylamino)-4-hydroxy-5-(4-phenoxybutyl)-1H-pyrimidin-6-one IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylamino)-4-hydroxy-5-(4-phenoxybutyl)-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-(indan-5-ylamino)-5-(4-phenoxybutyl)-1H-pyrimidin-6-one Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC3=NC(=C(C(=O)N3)CCCCOC4=CC=CC=C4)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC3=NC(=C(C(=O)N3)CCCCOC4=CC=CC=C4)O

InChI

InChI=1S/C23H25N3O3/c27-21-20(11-4-5-14-29-19-9-2-1-3-10-19)22(28)26-23(25-21)24-18-13-12-16-7-6-8-17(16)15-18/h1-3,9-10,12-13,15H,4-8,11,14H2,(H3,24,25,26,27,28)