2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(1-methyl-4-piperidin-1-iumylidene)amino]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide Formula: C15H19N4O2S+ MolecularWeight: 319.40196

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=NNC(=O)CSC2=NC3=CC=CC=C3O2)CC1

Isomeric SMILES

C[NH+]1CCC(=NNC(=O)CSC2=NC3=CC=CC=C3O2)CC1

InChI

InChI=1S/C15H18N4O2S/c1-19-8-6-11(7-9-19)17-18-14(20)10-22-15-16-12-4-2-3-5-13(12)21-15/h2-5H,6-10H2,1H3,(H,18,20)/p+1