1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(1,2-dihydroacenaphthylen-5-yl)piperidine-3-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(1,2-dihydroacenaphthylen-5-yl)piperidine-3-carboxamide Openeye Name: N-(1,2-dihydroacenaphthylen-5-yl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide CAS Name: N-(1,2-dihydroacenaphthylen-5-yl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-piperidinecarboxamide IUPAC Name: N-(1,2-dihydroacenaphthylen-5-yl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide Traditional Name: N-acenaphthen-5-yl-1-(1,1-diketo-1,2-benzothiazol-3-yl)nipecotamide Formula: C25H23N3O3S MolecularWeight: 445.53342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=C5C=CC=C6C5=C(CC6)C=C4

Isomeric SMILES

C1CC(CN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=C5C=CC=C6C5=C(CC6)C=C4

InChI

InChI=1S/C25H23N3O3S/c29-25(26-21-13-12-17-11-10-16-5-3-8-19(21)23(16)17)18-6-4-14-28(15-18)24-20-7-1-2-9-22(20)32(30,31)27-24/h1-3,5,7-9,12-13,18H,4,6,10-11,14-15H2,(H,26,29)