N-phenyl-4-[2-(phenylsulfonylamino)-1,2-dihydroacenaphthylen-1-yl]piperazine-1-carbothioamide

Systemtic Name: N-phenyl-4-[2-(phenylsulfonylamino)-1,2-dihydroacenaphthylen-1-yl]piperazine-1-carbothioamide Openeye Name: 4-[2-(benzenesulfonamido)-1,2-dihydroacenaphthylen-1-yl]-N-phenyl-piperazine-1-carbothioamide CAS Name: 4-[2-(benzenesulfonamido)-1,2-dihydroacenaphthylen-1-yl]-N-phenyl-1-piperazinecarbothioamide IUPAC Name: 4-[2-(benzenesulfonamido)-1,2-dihydroacenaphthylen-1-yl]-N-phenylpiperazine-1-carbothioamide Traditional Name: 4-[2-(benzenesulfonamido)acenaphthen-1-yl]-N-phenyl-piperazine-1-carbothioamide Formula: C29H28N4O2S2 MolecularWeight: 528.68822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2C(C3=CC=CC4=C3C2=CC=C4)NS(=O)(=O)C5=CC=CC=C5)C(=S)NC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2C(C3=CC=CC4=C3C2=CC=C4)NS(=O)(=O)C5=CC=CC=C5)C(=S)NC6=CC=CC=C6

InChI

InChI=1S/C29H28N4O2S2/c34-37(35,23-13-5-2-6-14-23)31-27-24-15-7-9-21-10-8-16-25(26(21)24)28(27)32-17-19-33(20-18-32)29(36)30-22-11-3-1-4-12-22/h1-16,27-28,31H,17-20H2,(H,30,36)