N-(5-methyl-1,3-thiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-(5-methyl-1,3-thiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(5-methylthiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-(5-methyl-2-thiazolyl)-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-(5-methyl-1,3-thiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-(5-methylthiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C17H22N3OS+ MolecularWeight: 316.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CN=C(S1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C17H21N3OS/c1-13-11-18-17(22-13)19-16(21)15-7-5-14(6-8-15)12-20-9-3-2-4-10-20/h5-8,11H,2-4,9-10,12H2,1H3,(H,18,19,21)/p+1