N-(2,6-diethylphenyl)-2-(2-phenylbenzo[h]quinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-(2-phenylbenzo[h]quinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-(2-phenylbenzo[h]quinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(2,6-diethylphenyl)-2-[(2-phenyl-4-benzo[h]quinazolinyl)thio]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-(2-phenylbenzo[h]quinazolin-4-yl)sulfanylacetamide Traditional Name: N-(2,6-diethylphenyl)-2-[(2-phenylbenzo[h]quinazolin-4-yl)thio]acetamide Formula: C30H27N3OS MolecularWeight: 477.61988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC(=NC3=C2C=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC(=NC3=C2C=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C30H27N3OS/c1-3-20-14-10-15-21(4-2)27(20)31-26(34)19-35-30-25-18-17-22-11-8-9-16-24(22)28(25)32-29(33-30)23-12-6-5-7-13-23/h5-18H,3-4,19H2,1-2H3,(H,31,34)