N,8-dimethyl-N-phenethyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide

Systemtic Name: N,8-dimethyl-N-phenethyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide Openeye Name: N,8-dimethyl-N-phenethyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide CAS Name: N,8-dimethyl-N-phenethyl-3-(4-thiomorpholin-4-iumylmethyl)-2-imidazo[1,2-a]pyridinecarboxamide IUPAC Name: N,8-dimethyl-N-phenethyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide Traditional Name: N,8-dimethyl-N-phenethyl-3-(thiomorpholin-4-ium-4-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide Formula: C23H29N4OS+ MolecularWeight: 409.56756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2C[NH+]3CCSCC3)C(=O)N(C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2C[NH+]3CCSCC3)C(=O)N(C)CCC4=CC=CC=C4

InChI

InChI=1S/C23H28N4OS/c1-18-7-6-11-27-20(17-26-13-15-29-16-14-26)21(24-22(18)27)23(28)25(2)12-10-19-8-4-3-5-9-19/h3-9,11H,10,12-17H2,1-2H3/p+1