1-[4-(phenylmethyl)piperidin-1-yl]-2-quinazolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-2-quinazolin-4-ylsulfanyl-ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-quinazolin-4-ylsulfanyl-ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-2-(4-quinazolinylthio)ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-quinazolin-4-ylsulfanylethanone Traditional Name: 1-(4-benzylpiperidino)-2-(quinazolin-4-ylthio)ethanone Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C22H23N3OS/c26-21(15-27-22-19-8-4-5-9-20(19)23-16-24-22)25-12-10-18(11-13-25)14-17-6-2-1-3-7-17/h1-9,16,18H,10-15H2