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

Systemtic Name: N-[(2-phenyl-1,3-thiazol-4-yl)methyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-[(2-phenylthiazol-4-yl)methyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[(2-phenyl-4-thiazolyl)methyl]-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-[(2-phenyl-1,3-thiazol-4-yl)methyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-[(2-phenylthiazol-4-yl)methyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C23H26N3OS+ MolecularWeight: 392.53704

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c27-22(19-11-9-18(10-12-19)16-26-13-5-2-6-14-26)24-15-21-17-28-23(25-21)20-7-3-1-4-8-20/h1,3-4,7-12,17H,2,5-6,13-16H2,(H,24,27)/p+1