N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-(quinazolin-4-ylthio)acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC(C)[C@H](C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C22H23N3O3S/c1-14(2)21(15-7-8-18-19(11-15)28-10-9-27-18)25-20(26)12-29-22-16-5-3-4-6-17(16)23-13-24-22/h3-8,11,13-14,21H,9-10,12H2,1-2H3,(H,25,26)/t21-/m1/s1