N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(E)-(1-methyl-2-pyrrolyl)methylideneamino]-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]-N-[(E)-(1-methylpyrrol-2-yl)methyleneamino]acetamide Formula: C22H19N5O2S MolecularWeight: 417.48356

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=NNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CN1C=CC=C1/C=N/NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C22H19N5O2S/c1-26-13-7-10-17(26)14-23-25-20(28)15-30-22-24-19-12-6-5-11-18(19)21(29)27(22)16-8-3-2-4-9-16/h2-14H,15H2,1H3,(H,25,28)/b23-14+