butyl-[(3E)-3-cyano-2-oxidanylidene-3-(4-phenyl-3H-1,3-thiazol-2-ylidene)propyl]-methyl-azanium

Systemtic Name: butyl-[(3E)-3-cyano-2-oxidanylidene-3-(4-phenyl-3H-1,3-thiazol-2-ylidene)propyl]-methyl-azanium Openeye Name: butyl-[(3E)-3-cyano-2-oxo-3-(4-phenyl-3H-thiazol-2-ylidene)propyl]-methyl-ammonium CAS Name: butyl-[(3E)-3-cyano-2-oxo-3-(4-phenyl-3H-thiazol-2-ylidene)propyl]-methylammonium IUPAC Name: butyl-[(3E)-3-cyano-2-oxo-3-(4-phenyl-3H-1,3-thiazol-2-ylidene)propyl]-methylazanium Traditional Name: butyl-[(3E)-3-cyano-2-keto-3-(4-phenyl-4-thiazolin-2-ylidene)propyl]-methyl-ammonium Formula: C18H22N3OS+ MolecularWeight: 328.45178

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC(=O)C(=C1NC(=CS1)C2=CC=CC=C2)C#N

Isomeric SMILES

CCCC[NH+](C)CC(=O)/C(=C/1\NC(=CS1)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C18H21N3OS/c1-3-4-10-21(2)12-17(22)15(11-19)18-20-16(13-23-18)14-8-6-5-7-9-14/h5-9,13,20H,3-4,10,12H2,1-2H3/p+1/b18-15+