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

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[(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=C1SCCC(=O)NC3=NC4=C(S3)C=C(C=C4)OCC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCCC(=O)NC3=NC4=C(S3)C=C(C=C4)OCC

InChI

InChI=1S/C22H22N4O3S2/c1-3-26-20(28)15-7-5-6-8-16(15)24-22(26)30-12-11-19(27)25-21-23-17-10-9-14(29-4-2)13-18(17)31-21/h5-10,13H,3-4,11-12H2,1-2H3,(H,23,25,27)