2-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-(thiophen-2-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-(thiophen-2-ylmethyl)quinazolin-4-one Openeye Name: 2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-(2-thienylmethyl)quinazolin-4-one CAS Name: 2-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-3-(thiophen-2-ylmethyl)-4-quinazolinone IUPAC Name: 2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-(thiophen-2-ylmethyl)quinazolin-4-one Traditional Name: 2-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methylthio]-3-(2-thenyl)quinazolin-4-one Formula: C22H16N4O2S2 MolecularWeight: 432.51804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC(=O)N4C=CC=CC4=N3)CC5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC(=O)N4C=CC=CC4=N3)CC5=CC=CS5

InChI

InChI=1S/C22H16N4O2S2/c27-20-12-15(23-19-9-3-4-10-25(19)20)14-30-22-24-18-8-2-1-7-17(18)21(28)26(22)13-16-6-5-11-29-16/h1-12H,13-14H2