N-aminocarbonyl-3-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]propanamide

Systemtic Name: N-aminocarbonyl-3-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]propanamide Openeye Name: N-carbamoyl-3-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]propanamide CAS Name: N-carbamoyl-3-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidin-1-iumyl]propanamide IUPAC Name: N-carbamoyl-3-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]propanamide Traditional Name: N-carbamoyl-3-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]propionamide Formula: C16H20ClN4O2S+ MolecularWeight: 367.8736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=C(S2)C=CC(=C3)Cl)CCC(=O)NC(=O)N

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=C(S2)C=CC(=C3)Cl)CCC(=O)NC(=O)N

InChI

InChI=1S/C16H19ClN4O2S/c17-11-1-2-13-12(9-11)19-15(24-13)10-3-6-21(7-4-10)8-5-14(22)20-16(18)23/h1-2,9-10H,3-8H2,(H3,18,20,22,23)/p+1