1-(azepan-1-yl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(2-isopropylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[(2-propan-2-yl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(2-isopropylquinazolin-4-yl)thio]ethanone Formula: C19H25N3OS MolecularWeight: 343.4863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCCCCC3

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCCCCC3

InChI

InChI=1S/C19H25N3OS/c1-14(2)18-20-16-10-6-5-9-15(16)19(21-18)24-13-17(23)22-11-7-3-4-8-12-22/h5-6,9-10,14H,3-4,7-8,11-13H2,1-2H3