N-(1,3-benzodioxol-5-yl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(quinazolin-4-ylthio)acetamide Formula: C17H13N3O3S MolecularWeight: 339.36842

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C17H13N3O3S/c21-16(20-11-5-6-14-15(7-11)23-10-22-14)8-24-17-12-3-1-2-4-13(12)18-9-19-17/h1-7,9H,8,10H2,(H,20,21)