(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-(thiophen-2-ylmethyl)azanium Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-(2-thienylmethyl)ammonium CAS Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-(thiophen-2-ylmethyl)azanium Traditional Name: (7-chloro-4-keto-1H-quinazolin-2-yl)methyl-ethyl-(2-thenyl)ammonium Formula: C16H17ClN3OS+ MolecularWeight: 334.84368

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CS1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC[NH+](CC1=CC=CS1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C16H16ClN3OS/c1-2-20(9-12-4-3-7-22-12)10-15-18-14-8-11(17)5-6-13(14)16(21)19-15/h3-8H,2,9-10H2,1H3,(H,18,19,21)/p+1