N-(3-cyano-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-cyano-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-4,5-dihydrobenzo[g]benzothiophen-2-yl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3-cyano-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(3-cyano-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-4,5-dihydrobenzo[g]benzothiophen-2-yl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C26H22N4O2S2 MolecularWeight: 486.60848

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C4=C(S3)C5=CC=CC=C5CC4)C#N

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C4=C(S3)C5=CC=CC=C5CC4)C#N

InChI

InChI=1S/C26H22N4O2S2/c1-3-30-25(32)19-10-6-7-11-21(19)28-26(30)33-15(2)23(31)29-24-20(14-27)18-13-12-16-8-4-5-9-17(16)22(18)34-24/h4-11,15H,3,12-13H2,1-2H3,(H,29,31)