(4E)-2-methoxy-4-[4-(1-pyridin-3-ylbutylamino)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-methoxy-4-[4-(1-pyridin-3-ylbutylamino)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-methoxy-4-[4-[1-(3-pyridyl)butylamino]-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-methoxy-4-[4-[1-(3-pyridinyl)butylamino]-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-methoxy-4-[4-(1-pyridin-3-ylbutylamino)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-methoxy-4-[4-[1-(3-pyridyl)butylamino]-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CN=CC=C1)NC2=CC(=C3C=CC(=O)C(=C3)OC)NC=N2

Isomeric SMILES

CCCC(C1=CN=CC=C1)NC2=C/C(=C\3/C=CC(=O)C(=C3)OC)/NC=N2

InChI

InChI=1S/C20H22N4O2/c1-3-5-16(15-6-4-9-21-12-15)24-20-11-17(22-13-23-20)14-7-8-18(25)19(10-14)26-2/h4,6-13,16,24H,3,5H2,1-2H3,(H,22,23)/b17-14+