N,N-dimethyl-4-[(S)-piperazin-4-ium-1-yl(1,3-thiazol-2-yl)methyl]aniline

Systemtic Name: N,N-dimethyl-4-[(S)-piperazin-4-ium-1-yl(1,3-thiazol-2-yl)methyl]aniline Openeye Name: N,N-dimethyl-4-[(S)-piperazin-4-ium-1-yl(thiazol-2-yl)methyl]aniline CAS Name: N,N-dimethyl-4-[(S)-1-piperazin-4-iumyl(2-thiazolyl)methyl]aniline IUPAC Name: N,N-dimethyl-4-[(S)-piperazin-4-ium-1-yl(1,3-thiazol-2-yl)methyl]aniline Traditional Name: dimethyl-[4-[(S)-piperazin-4-ium-1-yl(thiazol-2-yl)methyl]phenyl]amine Formula: C16H23N4S+ MolecularWeight: 303.44562

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=NC=CS2)N3CC[NH2+]CC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@@H](C2=NC=CS2)N3CC[NH2+]CC3

InChI

InChI=1S/C16H22N4S/c1-19(2)14-5-3-13(4-6-14)15(16-18-9-12-21-16)20-10-7-17-8-11-20/h3-6,9,12,15,17H,7-8,10-11H2,1-2H3/p+1/t15-/m0/s1