N-[4-[2-(phenylsulfonylamino)-1,2-dihydroacenaphthylen-1-yl]piperazin-1-yl]carbothioylbenzamide

Systemtic Name: N-[4-[2-(phenylsulfonylamino)-1,2-dihydroacenaphthylen-1-yl]piperazin-1-yl]carbothioylbenzamide Openeye Name: N-[4-[2-(benzenesulfonamido)-1,2-dihydroacenaphthylen-1-yl]piperazine-1-carbothioyl]benzamide CAS Name: N-[[4-[2-(benzenesulfonamido)-1,2-dihydroacenaphthylen-1-yl]-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: N-[4-[2-(benzenesulfonamido)-1,2-dihydroacenaphthylen-1-yl]piperazine-1-carbothioyl]benzamide Traditional Name: N-[4-[2-(benzenesulfonamido)acenaphthen-1-yl]piperazine-1-carbothioyl]benzamide Formula: C30H28N4O3S2 MolecularWeight: 556.69832

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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)NC(=O)C6=CC=CC=C6

Isomeric SMILES

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

InChI

InChI=1S/C30H28N4O3S2/c35-29(22-9-3-1-4-10-22)31-30(38)34-19-17-33(18-20-34)28-25-16-8-12-21-11-7-15-24(26(21)25)27(28)32-39(36,37)23-13-5-2-6-14-23/h1-16,27-28,32H,17-20H2,(H,31,35,38)