ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(2-sulfanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)methyl]azanium

Systemtic Name: ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(2-sulfanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)methyl]azanium Openeye Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[[5-(2-thienyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]ammonium CAS Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(2-sulfanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)methyl]ammonium IUPAC Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(2-sulfanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)methyl]azanium Traditional Name: ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]-[[5-(2-thienyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]ammonium Formula: C18H18N5O2S2+ MolecularWeight: 400.49782

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CN3C(=S)OC(=N3)C4=CC=CS4

Isomeric SMILES

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CN3C(=S)OC(=N3)C4=CC=CS4

InChI

InChI=1S/C18H17N5O2S2/c1-2-22(10-15-19-13-7-4-3-6-12(13)16(24)20-15)11-23-18(26)25-17(21-23)14-8-5-9-27-14/h3-9H,2,10-11H2,1H3,(H,19,20,24)/p+1