2-(2-phenylquinazolin-4-yl)sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-(2-phenylquinazolin-4-yl)sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-(2-phenylquinazolin-4-yl)sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[(2-phenyl-4-quinazolinyl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-(2-phenylquinazolin-4-yl)sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[(2-phenylquinazolin-4-yl)thio]-1-piperidino-ethanone Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3OS/c25-19(24-13-7-2-8-14-24)15-26-21-17-11-5-6-12-18(17)22-20(23-21)16-9-3-1-4-10-16/h1,3-6,9-12H,2,7-8,13-15H2