N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(8-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(8-ethyl-2-phenyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(8-ethyl-2-phenylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[(8-ethyl-2-phenyl-quinazolin-4-yl)thio]acetamide Formula: C27H24N4OS2 MolecularWeight: 484.63566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4OS2/c1-2-17-11-8-13-20-24(17)30-25(18-9-4-3-5-10-18)31-26(20)33-16-23(32)29-27-21(15-28)19-12-6-7-14-22(19)34-27/h3-5,8-11,13H,2,6-7,12,14,16H2,1H3,(H,29,32)