N-(1,3-benzothiazol-2-yl)-3-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-[(3-ethyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H18N4O2S2/c1-2-24-18(26)13-7-3-4-8-14(13)22-20(24)27-12-11-17(25)23-19-21-15-9-5-6-10-16(15)28-19/h3-10H,2,11-12H2,1H3,(H,21,23,25)