N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-(2-morpholino-1,3-benzothiazol-6-yl)propionamide Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)CCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)CCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C22H21N5O3S/c28-20(8-7-19-24-16-4-2-1-3-15(16)21(29)26-19)23-14-5-6-17-18(13-14)31-22(25-17)27-9-11-30-12-10-27/h1-6,13H,7-12H2,(H,23,28)(H,24,26,29)