N-(3,4-dimethylphenyl)-4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-amine

Systemtic Name: N-(3,4-dimethylphenyl)-4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-amine Openeye Name: N-(3,4-dimethylphenyl)-4-(morpholin-4-ium-4-ylmethyl)thiazol-2-amine CAS Name: N-(3,4-dimethylphenyl)-4-(4-morpholin-4-iumylmethyl)-2-thiazolamine IUPAC Name: N-(3,4-dimethylphenyl)-4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-amine Traditional Name: (3,4-dimethylphenyl)-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]amine Formula: C16H22N3OS+ MolecularWeight: 304.43038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=CS2)C[NH+]3CCOCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=CS2)C[NH+]3CCOCC3)C

InChI

InChI=1S/C16H21N3OS/c1-12-3-4-14(9-13(12)2)17-16-18-15(11-21-16)10-19-5-7-20-8-6-19/h3-4,9,11H,5-8,10H2,1-2H3,(H,17,18)/p+1