N-[2-chloranyl-5-(4-ethanoylpiperazin-1-yl)carbonyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-chloranyl-5-(4-ethanoylpiperazin-1-yl)carbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-(4-acetylpiperazine-1-carbonyl)-2-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[5-[(4-acetyl-1-piperazinyl)-oxomethyl]-2-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-(4-acetylpiperazine-1-carbonyl)-2-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[5-(4-acetylpiperazine-1-carbonyl)-2-chloro-phenyl]thiophene-2-carboxamide Formula: C18H18ClN3O3S MolecularWeight: 391.87182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C18H18ClN3O3S/c1-12(23)21-6-8-22(9-7-21)18(25)13-4-5-14(19)15(11-13)20-17(24)16-3-2-10-26-16/h2-5,10-11H,6-9H2,1H3,(H,20,24)