N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-naphthalen-1-yl-ethanesulfonamide

Systemtic Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-naphthalen-1-yl-ethanesulfonamide Openeye Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-(1-naphthyl)ethanesulfonamide CAS Name: N-[1-(1-benzotriazolylmethyl)-4-pyrazolyl]-2-(1-naphthalenyl)ethanesulfonamide IUPAC Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-naphthalen-1-ylethanesulfonamide Traditional Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-(1-naphthyl)ethanesulfonamide Formula: C22H20N6O2S MolecularWeight: 432.4982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CCS(=O)(=O)NC3=CN(N=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CCS(=O)(=O)NC3=CN(N=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C22H20N6O2S/c29-31(30,13-12-18-8-5-7-17-6-1-2-9-20(17)18)25-19-14-23-27(15-19)16-28-22-11-4-3-10-21(22)24-26-28/h1-11,14-15,25H,12-13,16H2