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

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-ethyl-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-ethyl-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-ethyl-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-ethyl-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-ethyl-2-(quinazolin-4-ylthio)acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1COC2=CC=CC=C2O1)C(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CCN(C[C@H]1COC2=CC=CC=C2O1)C(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C21H21N3O3S/c1-2-24(11-15-12-26-18-9-5-6-10-19(18)27-15)20(25)13-28-21-16-7-3-4-8-17(16)22-14-23-21/h3-10,14-15H,2,11-13H2,1H3/t15-/m0/s1