[(2R)-1-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropan-2-yl]-dimethyl-azanium

Systemtic Name: [(2R)-1-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-2-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-1-methyl-ethyl]-dimethyl-ammonium CAS Name: [(2R)-1-[[3-(4-chlorophenyl)-4-oxo-2-quinazolinyl]thio]propan-2-yl]-dimethylammonium IUPAC Name: [(2R)-1-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylpropan-2-yl]-dimethylazanium Traditional Name: [(1R)-2-[[3-(4-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-1-methyl-ethyl]-dimethyl-ammonium Formula: C19H21ClN3OS+ MolecularWeight: 374.90754

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl)[NH+](C)C

Isomeric SMILES

C[C@H](CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl)[NH+](C)C

InChI

InChI=1S/C19H20ClN3OS/c1-13(22(2)3)12-25-19-21-17-7-5-4-6-16(17)18(24)23(19)15-10-8-14(20)9-11-15/h4-11,13H,12H2,1-3H3/p+1/t13-/m1/s1