2-[4-[4-(1,3-dithian-2-yl)phenyl]carbonylpiperazin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[4-(1,3-dithian-2-yl)phenyl]carbonylpiperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[4-(1,3-dithian-2-yl)benzoyl]piperazin-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[4-(1,3-dithian-2-yl)benzoyl]piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[4-(1,3-dithian-2-yl)benzoyl]piperazino]-N-isopropyl-acetamide Formula: C20H29N3O2S2 MolecularWeight: 407.59316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCN(CC1)C(=O)C2=CC=C(C=C2)C3SCCCS3

Isomeric SMILES

CC(C)NC(=O)CN1CCN(CC1)C(=O)C2=CC=C(C=C2)C3SCCCS3

InChI

InChI=1S/C20H29N3O2S2/c1-15(2)21-18(24)14-22-8-10-23(11-9-22)19(25)16-4-6-17(7-5-16)20-26-12-3-13-27-20/h4-7,15,20H,3,8-14H2,1-2H3,(H,21,24)