N-heptan-2-yl-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-heptan-2-yl-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-methylhexyl)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-heptan-2-yl-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-heptan-2-yl-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-keto-3-methyl-quinazolin-2-yl)thio]-N-(1-methylhexyl)acetamide Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CCCCCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C18H25N3O2S/c1-4-5-6-9-13(2)19-16(22)12-24-18-20-15-11-8-7-10-14(15)17(23)21(18)3/h7-8,10-11,13H,4-6,9,12H2,1-3H3,(H,19,22)