N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(quinazolin-4-ylthio)acetamide Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCO2)NC(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C19H17N3O3S/c1-12(13-6-7-16-17(8-13)25-11-24-16)22-18(23)9-26-19-14-4-2-3-5-15(14)20-10-21-19/h2-8,10,12H,9,11H2,1H3,(H,22,23)/t12-/m1/s1