N-[(3S)-2-oxidanylidenethiolan-3-yl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[(3S)-2-oxidanylidenethiolan-3-yl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[(3S)-2-oxotetrahydrothiophen-3-yl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[(3S)-2-oxo-3-thiolanyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[(3S)-2-oxothiolan-3-yl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[(3S)-2-ketotetrahydrothiophen-3-yl]-2-(quinazolin-4-ylthio)acetamide Formula: C14H13N3O2S2 MolecularWeight: 319.40192

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=O)C1NC(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

C1CSC(=O)[C@H]1NC(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C14H13N3O2S2/c18-12(17-11-5-6-20-14(11)19)7-21-13-9-3-1-2-4-10(9)15-8-16-13/h1-4,8,11H,5-7H2,(H,17,18)/t11-/m0/s1