2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(2-tert-butyl-4-quinazolinyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(2-tert-butylquinazolin-4-yl)thio]-1-pyrrolidino-ethanone Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCCC3

InChI

InChI=1S/C18H23N3OS/c1-18(2,3)17-19-14-9-5-4-8-13(14)16(20-17)23-12-15(22)21-10-6-7-11-21/h4-5,8-9H,6-7,10-12H2,1-3H3