N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(quinazolin-4-ylthio)acetamide Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C19H16N4O4S/c24-17(10-28-18-13-3-1-2-4-14(13)20-11-21-18)23-19(25)22-12-5-6-15-16(9-12)27-8-7-26-15/h1-6,9,11H,7-8,10H2,(H2,22,23,24,25)