N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(quinazolin-4-ylthio)acetamide Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)CNC(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C19H17N3O3S/c23-18(11-26-19-14-5-1-2-6-15(14)21-12-22-19)20-9-13-10-24-16-7-3-4-8-17(16)25-13/h1-8,12-13H,9-11H2,(H,20,23)/t13-/m0/s1