[5-(1,3-benzothiazol-2-yl)thiophen-2-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-(1,3-benzothiazol-2-yl)thiophen-2-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-(1,3-benzothiazol-2-yl)-2-thienyl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [5-(1,3-benzothiazol-2-yl)-2-thiophenyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-(1,3-benzothiazol-2-yl)thiophen-2-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-(1,3-benzothiazol-2-yl)-2-thienyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C18H20N3OS2+ MolecularWeight: 358.5009

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H19N3OS2/c1-2-20-9-11-21(12-10-20)18(22)16-8-7-15(23-16)17-19-13-5-3-4-6-14(13)24-17/h3-8H,2,9-12H2,1H3/p+1