2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-ethyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21N3O4S/c1-2-24(12-19-22-16-6-4-3-5-15(16)21(26)23-19)20(25)13-29-14-7-8-17-18(11-14)28-10-9-27-17/h3-8,11H,2,9-10,12-13H2,1H3,(H,22,23,26)