N-(5-morpholin-4-ylpyridin-2-yl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(5-morpholin-4-ylpyridin-2-yl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(5-morpholino-2-pyridyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[5-(4-morpholinyl)-2-pyridinyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(5-morpholin-4-ylpyridin-2-yl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-(5-morpholino-2-pyridyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CN=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)NC(=S)N4

Isomeric SMILES

C1COCCN1C2=CN=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)NC(=S)N4

InChI

InChI=1S/C18H17N5O3S/c24-16(11-1-3-13-14(9-11)20-18(27)22-17(13)25)21-15-4-2-12(10-19-15)23-5-7-26-8-6-23/h1-4,9-10H,5-8H2,(H,19,21,24)(H2,20,22,25,27)