1-(azepan-1-yl)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[(2-cyclopropyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(2-cyclopropylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(2-cyclopropylquinazolin-4-yl)thio]ethanone Formula: C19H23N3OS MolecularWeight: 341.47042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4CC4

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4CC4

InChI

InChI=1S/C19H23N3OS/c23-17(22-11-5-1-2-6-12-22)13-24-19-15-7-3-4-8-16(15)20-18(21-19)14-9-10-14/h3-4,7-8,14H,1-2,5-6,9-13H2