(3Z)-3-[2-[(4-morpholin-4-ylphenyl)amino]-1H-pyrimidin-6-ylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carbonitrile

Systemtic Name: (3Z)-3-[2-[(4-morpholin-4-ylphenyl)amino]-1H-pyrimidin-6-ylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carbonitrile Openeye Name: (3Z)-3-[2-(4-morpholinoanilino)-1H-pyrimidin-6-ylidene]-6-oxo-cyclohexa-1,4-diene-1-carbonitrile CAS Name: (3Z)-3-[2-[4-(4-morpholinyl)anilino]-1H-pyrimidin-6-ylidene]-6-oxo-1-cyclohexa-1,4-dienecarbonitrile IUPAC Name: (3Z)-3-[2-(4-morpholin-4-ylanilino)-1H-pyrimidin-6-ylidene]-6-oxocyclohexa-1,4-diene-1-carbonitrile Traditional Name: (3Z)-6-keto-3-[2-(4-morpholinoanilino)-1H-pyrimidin-6-ylidene]cyclohexa-1,4-diene-1-carbonitrile Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NC=CC(=C4C=CC(=O)C(=C4)C#N)N3

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NC=C/C(=C/4\C=CC(=O)C(=C4)C#N)/N3

InChI

InChI=1S/C21H19N5O2/c22-14-16-13-15(1-6-20(16)27)19-7-8-23-21(25-19)24-17-2-4-18(5-3-17)26-9-11-28-12-10-26/h1-8,13H,9-12H2,(H2,23,24,25)/b19-15-