2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-(4-piperidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-(4-piperidin-1-ylphenyl)ethanamide Openeye Name: 2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[4-(1-piperidyl)phenyl]acetamide CAS Name: 2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]-N-[4-(1-piperidinyl)phenyl]acetamide IUPAC Name: 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)acetamide Traditional Name: 2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]-N-(4-piperidinophenyl)acetamide Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O2S/c33-26(29-22-13-15-23(16-14-22)31-17-7-2-8-18-31)20-35-28-30-25-12-6-5-11-24(25)27(34)32(28)19-21-9-3-1-4-10-21/h1,3-6,9-16H,2,7-8,17-20H2,(H,29,33)