(4-ethylpiperazin-4-ium-1-yl)-[5-(4-methoxyphenyl)furan-2-yl]methanethione

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[5-(4-methoxyphenyl)furan-2-yl]methanethione Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[5-(4-methoxyphenyl)-2-furyl]methanethione CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[5-(4-methoxyphenyl)-2-furanyl]methanethione IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[5-(4-methoxyphenyl)furan-2-yl]methanethione Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[5-(4-methoxyphenyl)-2-furyl]methanethione Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=S)C2=CC=C(O2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=S)C2=CC=C(O2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H22N2O2S/c1-3-19-10-12-20(13-11-19)18(23)17-9-8-16(22-17)14-4-6-15(21-2)7-5-14/h4-9H,3,10-13H2,1-2H3/p+1