N-(2,3-dihydro-1H-imidazo[2,1-b][1,3]benzothiazol-9-ium-7-yl)-3-methyl-benzamide

Systemtic Name: N-(2,3-dihydro-1H-imidazo[2,1-b][1,3]benzothiazol-9-ium-7-yl)-3-methyl-benzamide Openeye Name: N-(2,3-dihydro-1H-imidazo[2,1-b][1,3]benzothiazol-9-ium-7-yl)-3-methyl-benzamide CAS Name: N-(2,3-dihydro-1H-imidazo[2,1-b][1,3]benzothiazol-9-ium-7-yl)-3-methylbenzamide IUPAC Name: N-(2,3-dihydro-1H-imidazo[2,1-b][1,3]benzothiazol-9-ium-7-yl)-3-methylbenzamide Traditional Name: N-(2,3-dihydro-1H-imidazo[2,1-b][1,3]benzothiazol-9-ium-7-yl)-3-methyl-benzamide Formula: C17H16N3OS+ MolecularWeight: 310.39344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)SC4=[N+]3CCN4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)SC4=[N+]3CCN4

InChI

InChI=1S/C17H15N3OS/c1-11-3-2-4-12(9-11)16(21)19-13-5-6-15-14(10-13)20-8-7-18-17(20)22-15/h2-6,9-10H,7-8H2,1H3,(H,19,21)/p+1