2-(2-propylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(2-propylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(2-propylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(2-propyl-4-quinazolinyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(2-propylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(2-propylquinazolin-4-yl)thio]-1-pyrrolidino-ethanone Formula: C17H21N3OS MolecularWeight: 315.43314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCCC3

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCCC3

InChI

InChI=1S/C17H21N3OS/c1-2-7-15-18-14-9-4-3-8-13(14)17(19-15)22-12-16(21)20-10-5-6-11-20/h3-4,8-9H,2,5-7,10-12H2,1H3