N-(2-ethyl-6-methyl-phenyl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[(8-ethyl-2-phenyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(8-ethyl-2-phenylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[(8-ethyl-2-phenyl-quinazolin-4-yl)thio]acetamide Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=C(C=CC=C3CC)C)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=C(C=CC=C3CC)C)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3OS/c1-4-19-14-9-11-18(3)24(19)28-23(31)17-32-27-22-16-10-15-20(5-2)25(22)29-26(30-27)21-12-7-6-8-13-21/h6-16H,4-5,17H2,1-3H3,(H,28,31)