N-[2-(1-oxidanylnaphthalen-2-yl)carbonyl-1,3-benzothiazol-5-yl]dodecane-1-sulfonamide

Systemtic Name: N-[2-(1-oxidanylnaphthalen-2-yl)carbonyl-1,3-benzothiazol-5-yl]dodecane-1-sulfonamide Openeye Name: N-[2-(1-hydroxynaphthalene-2-carbonyl)-1,3-benzothiazol-5-yl]dodecane-1-sulfonamide CAS Name: N-[2-[(1-hydroxy-2-naphthalenyl)-oxomethyl]-1,3-benzothiazol-5-yl]-1-dodecanesulfonamide IUPAC Name: N-[2-(1-hydroxynaphthalene-2-carbonyl)-1,3-benzothiazol-5-yl]dodecane-1-sulfonamide Traditional Name: N-[2-(1-hydroxy-2-naphthoyl)-1,3-benzothiazol-5-yl]dodecane-1-sulfonamide Formula: C30H36N2O4S2 MolecularWeight: 552.74784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS(=O)(=O)NC1=CC2=C(C=C1)SC(=N2)C(=O)C3=C(C4=CC=CC=C4C=C3)O

Isomeric SMILES

CCCCCCCCCCCCS(=O)(=O)NC1=CC2=C(C=C1)SC(=N2)C(=O)C3=C(C4=CC=CC=C4C=C3)O

InChI

InChI=1S/C30H36N2O4S2/c1-2-3-4-5-6-7-8-9-10-13-20-38(35,36)32-23-17-19-27-26(21-23)31-30(37-27)29(34)25-18-16-22-14-11-12-15-24(22)28(25)33/h11-12,14-19,21,32-33H,2-10,13,20H2,1H3