N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(4-oxoquinazolin-3-yl)propanamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-oxoquinazolin-3-yl)propanamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(4-ketoquinazolin-3-yl)propionamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CCN3C=NC4=CC=CC=C4C3=O)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CCN3C=NC4=CC=CC=C4C3=O)C#N

InChI

InChI=1S/C20H18N4O2S/c21-11-15-13-5-2-4-8-17(13)27-19(15)23-18(25)9-10-24-12-22-16-7-3-1-6-14(16)20(24)26/h1,3,6-7,12H,2,4-5,8-10H2,(H,23,25)