2-[3-[2-(cyclohexen-1-yl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-phenylpropyl)ethanamide

Systemtic Name: 2-[3-[2-(cyclohexen-1-yl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-phenylpropyl)ethanamide Openeye Name: 2-[3-[2-(cyclohexen-1-yl)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-phenylpropyl)acetamide CAS Name: 2-[[3-[2-(1-cyclohexenyl)ethyl]-4-oxo-2-quinazolinyl]thio]-N-(2-phenylpropyl)acetamide IUPAC Name: 2-[3-[2-(cyclohexen-1-yl)ethyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(2-phenylpropyl)acetamide Traditional Name: 2-[[3-[2-(cyclohexen-1-yl)ethyl]-4-keto-quinazolin-2-yl]thio]-N-(2-phenylpropyl)acetamide Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC3=CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC3=CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2S/c1-20(22-12-6-3-7-13-22)18-28-25(31)19-33-27-29-24-15-9-8-14-23(24)26(32)30(27)17-16-21-10-4-2-5-11-21/h3,6-10,12-15,20H,2,4-5,11,16-19H2,1H3,(H,28,31)