2-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-(3-chlorobenzothiophene-2-carbonyl)piperazin-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-(3-chloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-(3-chlorobenzothiophene-2-carbonyl)piperazino]-N-isopropyl-acetamide Formula: C18H22ClN3O2S MolecularWeight: 379.90418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCN(CC1)C(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(C)NC(=O)CN1CCN(CC1)C(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C18H22ClN3O2S/c1-12(2)20-15(23)11-21-7-9-22(10-8-21)18(24)17-16(19)13-5-3-4-6-14(13)25-17/h3-6,12H,7-11H2,1-2H3,(H,20,23)