N-(1,3-benzothiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C20H22N3OS+ MolecularWeight: 352.47318

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3OS/c24-19(22-20-21-17-6-2-3-7-18(17)25-20)16-10-8-15(9-11-16)14-23-12-4-1-5-13-23/h2-3,6-11H,1,4-5,12-14H2,(H,21,22,24)/p+1