6-[2-azanyl-5-(1,3-benzodioxol-5-yl)-1H-pyrimidin-6-ylidene]-5-ethyl-3-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[2-azanyl-5-(1,3-benzodioxol-5-yl)-1H-pyrimidin-6-ylidene]-5-ethyl-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(1,3-benzodioxol-5-yl)-1H-pyrimidin-6-ylidene]-5-ethyl-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(1,3-benzodioxol-5-yl)-1H-pyrimidin-6-ylidene]-5-ethyl-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(1,3-benzodioxol-5-yl)-1H-pyrimidin-6-ylidene]-5-ethyl-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(1,3-benzodioxol-5-yl)-1H-pyrimidin-6-ylidene]-5-ethyl-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=O)C1=C2C(=CN=C(N2)N)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

CCC1=CC(=CC(=O)C1=C2C(=CN=C(N2)N)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C20H19N3O4/c1-3-11-6-13(25-2)8-15(24)18(11)19-14(9-22-20(21)23-19)12-4-5-16-17(7-12)27-10-26-16/h4-9H,3,10H2,1-2H3,(H3,21,22,23)