2-[2,4-bis(oxidanylidene)quinazolin-1-yl]-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]ethanamide

Systemtic Name: 2-[2,4-bis(oxidanylidene)quinazolin-1-yl]-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]ethanamide Openeye Name: 2-(2,4-dioxoquinazolin-1-yl)-N-[4-(3-pyridylmethylsulfanyl)phenyl]acetamide CAS Name: 2-(2,4-dioxo-1-quinazolinyl)-N-[4-(3-pyridinylmethylthio)phenyl]acetamide IUPAC Name: 2-(2,4-dioxoquinazolin-1-yl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]acetamide Traditional Name: 2-(2,4-diketoquinazolin-1-yl)-N-[4-(3-pyridylmethylthio)phenyl]acetamide Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(=O)N2CC(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC(=O)N2CC(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C22H18N4O3S/c27-20(13-26-19-6-2-1-5-18(19)21(28)25-22(26)29)24-16-7-9-17(10-8-16)30-14-15-4-3-11-23-12-15/h1-12H,13-14H2,(H,24,27)(H,25,28,29)