azepan-1-yl-[7-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methanone

Systemtic Name: azepan-1-yl-[7-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methanone Openeye Name: azepan-1-yl-[7-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methanone CAS Name: 1-azepanyl-[7-methyl-3-(4-thiomorpholin-4-iumylmethyl)-2-imidazo[1,2-a]pyridinyl]methanone IUPAC Name: azepan-1-yl-[7-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methanone Traditional Name: azepan-1-yl-[7-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methanone Formula: C20H29N4OS+ MolecularWeight: 373.53546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(N2C=C1)C[NH+]3CCSCC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC2=NC(=C(N2C=C1)C[NH+]3CCSCC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C20H28N4OS/c1-16-6-9-24-17(15-22-10-12-26-13-11-22)19(21-18(24)14-16)20(25)23-7-4-2-3-5-8-23/h6,9,14H,2-5,7-8,10-13,15H2,1H3/p+1