N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-6-oxidanyl-naphthalene-2-carboxamide

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-6-oxidanyl-naphthalene-2-carboxamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-6-hydroxy-naphthalene-2-carboxamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]amino]ethyl]-6-hydroxy-2-naphthalenecarboxamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]amino]ethyl]-6-hydroxynaphthalene-2-carboxamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-6-hydroxy-2-naphthamide Formula: C27H28N6O3 MolecularWeight: 484.54962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NCCNC(=O)C2=CC3=C(C=C2)C=C(C=C3)O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NCCNC(=O)C2=CC3=C(C=C2)C=C(C=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C27H28N6O3/c1-18(34)28-11-12-29-24-17-25(33-26(32-24)19-5-3-2-4-6-19)30-13-14-31-27(36)22-8-7-21-16-23(35)10-9-20(21)15-22/h2-10,15-17,35H,11-14H2,1H3,(H,28,34)(H,31,36)(H2,29,30,32,33)