2-morpholin-4-ium-4-yl-1-[4-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-morpholin-4-ium-4-yl-1-[4-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 2-morpholin-4-ium-4-yl-1-[4-[(2-thioxo-1,3-benzoxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 2-(4-morpholin-4-iumyl)-1-[4-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-morpholin-4-ium-4-yl-1-[4-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 2-morpholin-4-ium-4-yl-1-[4-[(2-thioxo-1,3-benzoxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone Formula: C18H26N4O3S+2 MolecularWeight: 378.48904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C3=CC=CC=C3OC2=S)C(=O)C[NH+]4CCOCC4

Isomeric SMILES

C1CN(CC[NH+]1CN2C3=CC=CC=C3OC2=S)C(=O)C[NH+]4CCOCC4

InChI

InChI=1S/C18H24N4O3S/c23-17(13-19-9-11-24-12-10-19)21-7-5-20(6-8-21)14-22-15-3-1-2-4-16(15)25-18(22)26/h1-4H,5-14H2/p+2