6-azanyl-4-(2-chlorophenyl)-3,5-dicyano-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium

Systemtic Name: 6-azanyl-4-(2-chlorophenyl)-3,5-dicyano-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium Openeye Name: 6-amino-4-(2-chlorophenyl)-3,5-dicyano-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium CAS Name: 6-amino-4-(2-chlorophenyl)-3,5-dicyano-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium IUPAC Name: 6-amino-4-(2-chlorophenyl)-3,5-dicyano-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium Traditional Name: 6-amino-4-(2-chlorophenyl)-3,5-dicyano-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium Formula: C18H20ClN5OS MolecularWeight: 389.9023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCOCC1.C1=CC=C(C(=C1)C2C(=C(NC(=C2C#N)[S-])N)C#N)Cl

Isomeric SMILES

C[NH+]1CCOCC1.C1=CC=C(C(=C1)C2C(=C(NC(=C2C#N)[S-])N)C#N)Cl

InChI

InChI=1S/C13H9ClN4S.C5H11NO/c14-10-4-2-1-3-7(10)11-8(5-15)12(17)18-13(19)9(11)6-16;1-6-2-4-7-5-3-6/h1-4,11,18-19H,17H2;2-5H2,1H3