(3Z)-3-[2-[(3-chlorophenyl)amino]-1H-pyrimidin-6-ylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxamide

Systemtic Name: (3Z)-3-[2-[(3-chlorophenyl)amino]-1H-pyrimidin-6-ylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxamide Openeye Name: (3Z)-3-[2-(3-chloroanilino)-1H-pyrimidin-6-ylidene]-6-oxo-cyclohexa-1,4-diene-1-carboxamide CAS Name: (3Z)-3-[2-(3-chloroanilino)-1H-pyrimidin-6-ylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxamide IUPAC Name: (3Z)-3-[2-(3-chloroanilino)-1H-pyrimidin-6-ylidene]-6-oxocyclohexa-1,4-diene-1-carboxamide Traditional Name: (3Z)-3-[2-(3-chloroanilino)-1H-pyrimidin-6-ylidene]-6-keto-cyclohexa-1,4-diene-1-carboxamide Formula: C17H13ClN4O2 MolecularWeight: 340.76372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=C3C=CC(=O)C(=C3)C(=O)N)N2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=C/C(=C/3\C=CC(=O)C(=C3)C(=O)N)/N2

InChI

InChI=1S/C17H13ClN4O2/c18-11-2-1-3-12(9-11)21-17-20-7-6-14(22-17)10-4-5-15(23)13(8-10)16(19)24/h1-9H,(H2,19,24)(H2,20,21,22)/b14-10-