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

Systemtic Name: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [3-(1,3-benzothiazol-2-yl)-2-pyrazinyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C18H20N5OS+ MolecularWeight: 354.4493

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H19N5OS/c1-2-22-9-11-23(12-10-22)18(24)16-15(19-7-8-20-16)17-21-13-5-3-4-6-14(13)25-17/h3-8H,2,9-12H2,1H3/p+1