[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 4-methyl-N-phenyl-piperazin-4-ium-1-carboximidothioate

Systemtic Name: [2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 4-methyl-N-phenyl-piperazin-4-ium-1-carboximidothioate Openeye Name: [2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl] 4-methyl-N-phenyl-piperazin-4-ium-1-carboximidothioate CAS Name: 4-methyl-N-phenyl-1-piperazin-4-iumcarboximidothioic acid [2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl] 4-methyl-N-phenylpiperazin-4-ium-1-carboximidothioate Traditional Name: 4-methyl-N-phenyl-piperazin-4-ium-1-carboximidothioic acid [2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl] ester Formula: C18H24N5OS2+ MolecularWeight: 390.54606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CSC(=NC2=CC=CC=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CSC(=NC2=CC=CC=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C18H23N5OS2/c1-14-12-25-17(19-14)21-16(24)13-26-18(20-15-6-4-3-5-7-15)23-10-8-22(2)9-11-23/h3-7,12H,8-11,13H2,1-2H3,(H,19,21,24)/p+1