N-(2-methyl-2-morpholin-4-yl-butyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(2-methyl-2-morpholin-4-yl-butyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(2-methyl-2-morpholino-butyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-methyl-2-(4-morpholinyl)butyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(2-methyl-2-morpholin-4-ylbutyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-(2-methyl-2-morpholino-butyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CNC(=O)C1=CC2=C(C=C1)C(=O)NC(=S)N2)N3CCOCC3

Isomeric SMILES

CCC(C)(CNC(=O)C1=CC2=C(C=C1)C(=O)NC(=S)N2)N3CCOCC3

InChI

InChI=1S/C18H24N4O3S/c1-3-18(2,22-6-8-25-9-7-22)11-19-15(23)12-4-5-13-14(10-12)20-17(26)21-16(13)24/h4-5,10H,3,6-9,11H2,1-2H3,(H,19,23)(H2,20,21,24,26)