diethyl-[3-(6-morpholin-4-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propyl]azanium

Systemtic Name: diethyl-[3-(6-morpholin-4-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propyl]azanium Openeye Name: diethyl-[3-(6-morpholino-4-oxo-2-thioxo-1H-quinazolin-3-yl)propyl]ammonium CAS Name: diethyl-[3-[6-(4-morpholinyl)-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl]propyl]ammonium IUPAC Name: diethyl-[3-(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]azanium Traditional Name: diethyl-[3-(4-keto-6-morpholino-2-thioxo-1H-quinazolin-3-yl)propyl]ammonium Formula: C19H29N4O2S+ MolecularWeight: 377.52416

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(=O)C2=C(C=CC(=C2)N3CCOCC3)NC1=S

Isomeric SMILES

CC[NH+](CC)CCCN1C(=O)C2=C(C=CC(=C2)N3CCOCC3)NC1=S

InChI

InChI=1S/C19H28N4O2S/c1-3-21(4-2)8-5-9-23-18(24)16-14-15(22-10-12-25-13-11-22)6-7-17(16)20-19(23)26/h6-7,14H,3-5,8-13H2,1-2H3,(H,20,26)/p+1