2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamide

Systemtic Name: 2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamide Openeye Name: 2-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-tetralin-1-yl-acetamide CAS Name: 2-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide IUPAC Name: 2-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide Traditional Name: 2-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]-N-tetralin-1-yl-acetamide Formula: C27H25N3O2S MolecularWeight: 455.5713

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCC5=CC=CC=C45

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCC5=CC=CC=C45

InChI

InChI=1S/C27H25N3O2S/c1-18-9-2-7-16-24(18)30-26(32)21-13-5-6-14-23(21)29-27(30)33-17-25(31)28-22-15-8-11-19-10-3-4-12-20(19)22/h2-7,9-10,12-14,16,22H,8,11,15,17H2,1H3,(H,28,31)