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

Systemtic Name: N,N-dimethyl-4-[(S)-(4-methyl-1,3-thiazol-2-yl)-piperazin-4-ium-1-yl-methyl]aniline Openeye Name: N,N-dimethyl-4-[(S)-(4-methylthiazol-2-yl)-piperazin-4-ium-1-yl-methyl]aniline CAS Name: N,N-dimethyl-4-[(S)-(4-methyl-2-thiazolyl)-(1-piperazin-4-iumyl)methyl]aniline IUPAC Name: N,N-dimethyl-4-[(S)-(4-methyl-1,3-thiazol-2-yl)-piperazin-4-ium-1-ylmethyl]aniline Traditional Name: dimethyl-[4-[(S)-(4-methylthiazol-2-yl)-piperazin-4-ium-1-yl-methyl]phenyl]amine Formula: C17H25N4S+ MolecularWeight: 317.4722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C2=CC=C(C=C2)N(C)C)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CSC(=N1)[C@H](C2=CC=C(C=C2)N(C)C)N3CC[NH2+]CC3

InChI

InChI=1S/C17H24N4S/c1-13-12-22-17(19-13)16(21-10-8-18-9-11-21)14-4-6-15(7-5-14)20(2)3/h4-7,12,16,18H,8-11H2,1-3H3/p+1/t16-/m0/s1