1-(1,3-benzodioxol-5-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(1,3-benzodioxol-5-yl)-2-[(2-methyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-(2-methylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-[(2-methylquinazolin-4-yl)thio]ethanone Formula: C18H14N2O3S MolecularWeight: 338.38036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H14N2O3S/c1-11-19-14-5-3-2-4-13(14)18(20-11)24-9-15(21)12-6-7-16-17(8-12)23-10-22-16/h2-8H,9-10H2,1H3