2-[(E)-3-naphthalen-2-ylsulfonylprop-2-enyl]sulfanyl-5-(phenylmethyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(E)-3-naphthalen-2-ylsulfonylprop-2-enyl]sulfanyl-5-(phenylmethyl)-1,3,4-oxadiazole Openeye Name: 2-benzyl-5-[(E)-3-(2-naphthylsulfonyl)allyl]sulfanyl-1,3,4-oxadiazole CAS Name: 2-[[(E)-3-(2-naphthalenylsulfonyl)prop-2-enyl]thio]-5-(phenylmethyl)-1,3,4-oxadiazole IUPAC Name: 2-benzyl-5-[(E)-3-naphthalen-2-ylsulfonylprop-2-enyl]sulfanyl-1,3,4-oxadiazole Traditional Name: 2-benzyl-5-[[(E)-3-(2-naphthylsulfonyl)allyl]thio]-1,3,4-oxadiazole Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(O2)SCC=CS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(O2)SC/C=C/S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H18N2O3S2/c25-29(26,20-12-11-18-9-4-5-10-19(18)16-20)14-6-13-28-22-24-23-21(27-22)15-17-7-2-1-3-8-17/h1-12,14,16H,13,15H2/b14-6+