2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[4-oxo-3-(p-tolylmethyl)quinazolin-2-yl]sulfanyl-N-(3-phenylpropyl)acetamide CAS Name: 2-[[3-[(4-methylphenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[3-[(4-methylphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(3-phenylpropyl)acetamide Traditional Name: 2-[[4-keto-3-(4-methylbenzyl)quinazolin-2-yl]thio]-N-(3-phenylpropyl)acetamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2S/c1-20-13-15-22(16-14-20)18-30-26(32)23-11-5-6-12-24(23)29-27(30)33-19-25(31)28-17-7-10-21-8-3-2-4-9-21/h2-6,8-9,11-16H,7,10,17-19H2,1H3,(H,28,31)