5-(azocan-1-ium-1-ylmethyl)-N-methyl-N-phenethyl-imidazo[2,1-b][1,3]thiazole-6-carboxamide

Systemtic Name: 5-(azocan-1-ium-1-ylmethyl)-N-methyl-N-phenethyl-imidazo[2,1-b][1,3]thiazole-6-carboxamide Openeye Name: 5-(azocan-1-ium-1-ylmethyl)-N-methyl-N-phenethyl-imidazo[2,1-b]thiazole-6-carboxamide CAS Name: 5-(1-azocan-1-iumylmethyl)-N-methyl-N-phenethyl-6-imidazo[2,1-b]thiazolecarboxamide IUPAC Name: 5-(azocan-1-ium-1-ylmethyl)-N-methyl-N-phenethylimidazo[2,1-b][1,3]thiazole-6-carboxamide Traditional Name: 5-(azocan-1-ium-1-ylmethyl)-N-methyl-N-phenethyl-imidazo[2,1-b]thiazole-6-carboxamide Formula: C23H31N4OS+ MolecularWeight: 411.58344

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)C2=C(N3C=CSC3=N2)C[NH+]4CCCCCCC4

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)C2=C(N3C=CSC3=N2)C[NH+]4CCCCCCC4

InChI

InChI=1S/C23H30N4OS/c1-25(15-12-19-10-6-5-7-11-19)22(28)21-20(27-16-17-29-23(27)24-21)18-26-13-8-3-2-4-9-14-26/h5-7,10-11,16-17H,2-4,8-9,12-15,18H2,1H3/p+1