2-methyl-5-methylsulfanyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 2-methyl-5-methylsulfanyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-2-methyl-5-methylsulfanyl-benzamide CAS Name: 2-methyl-5-(methylthio)-N-(1-propan-2-yl-4-piperidin-1-iumyl)benzamide IUPAC Name: 2-methyl-5-methylsulfanyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-2-methyl-5-(methylthio)benzamide Formula: C17H27N2OS+ MolecularWeight: 307.47408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC)C(=O)NC2CC[NH+](CC2)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC)C(=O)NC2CC[NH+](CC2)C(C)C

InChI

InChI=1S/C17H26N2OS/c1-12(2)19-9-7-14(8-10-19)18-17(20)16-11-15(21-4)6-5-13(16)3/h5-6,11-12,14H,7-10H2,1-4H3,(H,18,20)/p+1