(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl-ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl-ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: (5-chlorothiadiazol-4-yl)methyl-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: (5-chloro-4-thiadiazolyl)methyl-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: (5-chlorothiadiazol-4-yl)methyl-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: (5-chlorothiadiazol-4-yl)methyl-ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C14H15ClN5OS+ MolecularWeight: 336.8198

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=C(SN=N1)Cl)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC[NH+](CC1=C(SN=N1)Cl)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C14H14ClN5OS/c1-2-20(7-11-13(15)22-19-18-11)8-12-16-10-6-4-3-5-9(10)14(21)17-12/h3-6H,2,7-8H2,1H3,(H,16,17,21)/p+1