6-bromanyl-3-(6-morpholin-4-yl-6-oxidanylidene-hexyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-(6-morpholin-4-yl-6-oxidanylidene-hexyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-bromo-3-(6-morpholino-6-oxo-hexyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-bromo-3-[6-(4-morpholinyl)-6-oxohexyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-bromo-3-(6-morpholin-4-yl-6-oxohexyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-bromo-3-(6-keto-6-morpholino-hexyl)-2-thioxo-1H-quinazolin-4-one Formula: C18H22BrN3O3S MolecularWeight: 440.35458

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CCCCCN2C(=O)C3=C(C=CC(=C3)Br)NC2=S

Isomeric SMILES

C1COCCN1C(=O)CCCCCN2C(=O)C3=C(C=CC(=C3)Br)NC2=S

InChI

InChI=1S/C18H22BrN3O3S/c19-13-5-6-15-14(12-13)17(24)22(18(26)20-15)7-3-1-2-4-16(23)21-8-10-25-11-9-21/h5-6,12H,1-4,7-11H2,(H,20,26)