4-[[4-[(4-chloranyl-1-oxidanylidene-2,3-dihydroinden-5-yl)oxy]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[(4-chloranyl-1-oxidanylidene-2,3-dihydroinden-5-yl)oxy]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(4-chloro-1-oxo-indan-5-yl)oxypyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-[(4-chloro-1-oxo-2,3-dihydroinden-5-yl)oxy]-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-[(4-chloro-1-oxo-2,3-dihydroinden-5-yl)oxy]pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-(4-chloro-1-keto-indan-5-yl)oxypyrimidin-2-yl]amino]benzonitrile Formula: C20H13ClN4O2 MolecularWeight: 376.79582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C1C(=C(C=C2)OC3=NC(=NC=C3)NC4=CC=C(C=C4)C#N)Cl

Isomeric SMILES

C1CC(=O)C2=C1C(=C(C=C2)OC3=NC(=NC=C3)NC4=CC=C(C=C4)C#N)Cl

InChI

InChI=1S/C20H13ClN4O2/c21-19-15-5-7-16(26)14(15)6-8-17(19)27-18-9-10-23-20(25-18)24-13-3-1-12(11-22)2-4-13/h1-4,6,8-10H,5,7H2,(H,23,24,25)