(6Z)-6-[2-azanyl-5-[4-(3-phenylmethoxypropoxy)phenyl]-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[2-azanyl-5-[4-(3-phenylmethoxypropoxy)phenyl]-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[2-amino-5-[4-(3-benzyloxypropoxy)phenyl]-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[2-amino-5-[4-(3-phenylmethoxypropoxy)phenyl]-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[2-amino-5-[4-(3-phenylmethoxypropoxy)phenyl]-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[2-amino-5-[4-(3-benzoxypropoxy)phenyl]-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Formula: C26H25N3O3 MolecularWeight: 427.495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCOC2=CC=C(C=C2)C3=CN=C(NC3=C4C=CC=CC4=O)N

Isomeric SMILES

C1=CC=C(C=C1)COCCCOC2=CC=C(C=C2)C\3=CN=C(N/C3=C\4/C=CC=CC4=O)N

InChI

InChI=1S/C26H25N3O3/c27-26-28-17-23(25(29-26)22-9-4-5-10-24(22)30)20-11-13-21(14-12-20)32-16-6-15-31-18-19-7-2-1-3-8-19/h1-5,7-14,17H,6,15-16,18H2,(H3,27,28,29)/b25-22-