N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=NC4=C(S3)C=C(C=C4)OCC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=NC4=C(S3)C=C(C=C4)OCC

InChI

InChI=1S/C22H22N4O3S2/c1-4-26-20(28)15-8-6-7-9-16(15)24-22(26)30-13(3)19(27)25-21-23-17-11-10-14(29-5-2)12-18(17)31-21/h6-13H,4-5H2,1-3H3,(H,23,25,27)