2-[4-(5-acetamidothiophen-2-yl)carbonylpiperazin-1-ium-1-yl]-N-(2-chlorophenyl)ethanamide

Systemtic Name: 2-[4-(5-acetamidothiophen-2-yl)carbonylpiperazin-1-ium-1-yl]-N-(2-chlorophenyl)ethanamide Openeye Name: 2-[4-(5-acetamidothiophene-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide CAS Name: 2-[4-[(5-acetamido-2-thiophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(2-chlorophenyl)acetamide IUPAC Name: 2-[4-(5-acetamidothiophene-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide Traditional Name: 2-[4-(5-acetamidothiophene-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide Formula: C19H22ClN4O3S+ MolecularWeight: 421.92098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(S1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)NC1=CC=C(S1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C19H21ClN4O3S/c1-13(25)21-18-7-6-16(28-18)19(27)24-10-8-23(9-11-24)12-17(26)22-15-5-3-2-4-14(15)20/h2-7H,8-12H2,1H3,(H,21,25)(H,22,26)/p+1