2-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)-1,3-benzothiazole

Systemtic Name: 2-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)-1,3-benzothiazole Openeye Name: 2-[1-(2-naphthylsulfonyl)pyrrolidin-2-yl]-1,3-benzothiazole CAS Name: 2-[1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]-1,3-benzothiazole IUPAC Name: 2-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)-1,3-benzothiazole Traditional Name: 2-[1-(2-naphthylsulfonyl)pyrrolidin-2-yl]-1,3-benzothiazole Formula: C21H18N2O2S2 MolecularWeight: 394.50982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H18N2O2S2/c24-27(25,17-12-11-15-6-1-2-7-16(15)14-17)23-13-5-9-19(23)21-22-18-8-3-4-10-20(18)26-21/h1-4,6-8,10-12,14,19H,5,9,13H2