N-(2,6-dimethylphenyl)-3-(3-morpholin-4-ylpropyl)-4-thiophen-2-yl-1,3-thiazol-3-ium-2-amine

Systemtic Name: N-(2,6-dimethylphenyl)-3-(3-morpholin-4-ylpropyl)-4-thiophen-2-yl-1,3-thiazol-3-ium-2-amine Openeye Name: N-(2,6-dimethylphenyl)-3-(3-morpholinopropyl)-4-(2-thienyl)thiazol-3-ium-2-amine CAS Name: N-(2,6-dimethylphenyl)-3-[3-(4-morpholinyl)propyl]-4-thiophen-2-yl-2-thiazol-3-iumamine IUPAC Name: N-(2,6-dimethylphenyl)-3-(3-morpholin-4-ylpropyl)-4-thiophen-2-yl-1,3-thiazol-3-ium-2-amine Traditional Name: (2,6-dimethylphenyl)-[3-(3-morpholinopropyl)-4-(2-thienyl)thiazol-3-ium-2-yl]amine Formula: C22H28N3OS2+ MolecularWeight: 414.60722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=[N+](C(=CS2)C3=CC=CS3)CCCN4CCOCC4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=[N+](C(=CS2)C3=CC=CS3)CCCN4CCOCC4

InChI

InChI=1S/C22H27N3OS2/c1-17-6-3-7-18(2)21(17)23-22-25(10-5-9-24-11-13-26-14-12-24)19(16-28-22)20-8-4-15-27-20/h3-4,6-8,15-16H,5,9-14H2,1-2H3/p+1