(6-chloranyl-4-ethynyl-3-methyl-5-oxidanylidene-4-phenyl-6H-quinazolin-2-yl)cyanamide

Systemtic Name: (6-chloranyl-4-ethynyl-3-methyl-5-oxidanylidene-4-phenyl-6H-quinazolin-2-yl)cyanamide Openeye Name: (6-chloro-4-ethynyl-3-methyl-5-oxo-4-phenyl-6H-quinazolin-2-yl)cyanamide CAS Name: (6-chloro-4-ethynyl-3-methyl-5-oxo-4-phenyl-6H-quinazolin-2-yl)cyanamide IUPAC Name: (6-chloro-4-ethynyl-3-methyl-5-oxo-4-phenyl-6H-quinazolin-2-yl)cyanamide Traditional Name: (6-chloro-4-ethynyl-5-keto-3-methyl-4-phenyl-6H-quinazolin-2-yl)cyanamide Formula: C18H13ClN4O MolecularWeight: 336.77502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C(C1(C#C)C3=CC=CC=C3)C(=O)C(C=C2)Cl)NC#N

Isomeric SMILES

CN1C(=NC2=C(C1(C#C)C3=CC=CC=C3)C(=O)C(C=C2)Cl)NC#N

InChI

InChI=1S/C18H13ClN4O/c1-3-18(12-7-5-4-6-8-12)15-14(10-9-13(19)16(15)24)22-17(21-11-20)23(18)2/h1,4-10,13H,2H3,(H,21,22)