3-[[4-(decylamino)-6-fluoranyl-1,3,5-triazin-2-yl]amino]-7-methoxy-chromen-2-one

Systemtic Name: 3-[[4-(decylamino)-6-fluoranyl-1,3,5-triazin-2-yl]amino]-7-methoxy-chromen-2-one Openeye Name: 3-[[4-(decylamino)-6-fluoro-1,3,5-triazin-2-yl]amino]-7-methoxy-chromen-2-one CAS Name: 3-[[4-(decylamino)-6-fluoro-1,3,5-triazin-2-yl]amino]-7-methoxy-1-benzopyran-2-one IUPAC Name: 3-[[4-(decylamino)-6-fluoro-1,3,5-triazin-2-yl]amino]-7-methoxychromen-2-one Traditional Name: 3-[[4-(decylamino)-6-fluoro-s-triazin-2-yl]amino]-7-methoxy-coumarin Formula: C23H30FN5O3 MolecularWeight: 443.514403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC1=NC(=NC(=N1)NC2=CC3=C(C=C(C=C3)OC)OC2=O)F

Isomeric SMILES

CCCCCCCCCCNC1=NC(=NC(=N1)NC2=CC3=C(C=C(C=C3)OC)OC2=O)F

InChI

InChI=1S/C23H30FN5O3/c1-3-4-5-6-7-8-9-10-13-25-22-27-21(24)28-23(29-22)26-18-14-16-11-12-17(31-2)15-19(16)32-20(18)30/h11-12,14-15H,3-10,13H2,1-2H3,(H2,25,26,27,28,29)