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

Systemtic Name: 1-piperidin-1-yl-2-(2-propan-2-ylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 2-(2-isopropylquinazolin-4-yl)sulfanyl-1-(1-piperidyl)ethanone CAS Name: 1-(1-piperidinyl)-2-[(2-propan-2-yl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-piperidin-1-yl-2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanone Traditional Name: 2-[(2-isopropylquinazolin-4-yl)thio]-1-piperidino-ethanone Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCCCC3

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCCCC3

InChI

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