5-(1,3-benzodioxol-5-yl)-3-(2-methylpropoxy)-1-naphthalen-1-ylsulfonyl-1,2,4-triazole

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3-(2-methylpropoxy)-1-naphthalen-1-ylsulfonyl-1,2,4-triazole Openeye Name: 5-(1,3-benzodioxol-5-yl)-3-isobutoxy-1-(1-naphthylsulfonyl)-1,2,4-triazole CAS Name: 5-(1,3-benzodioxol-5-yl)-3-(2-methylpropoxy)-1-(1-naphthalenylsulfonyl)-1,2,4-triazole IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-(2-methylpropoxy)-1-naphthalen-1-ylsulfonyl-1,2,4-triazole Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-isobutoxy-1-(1-naphthylsulfonyl)-1,2,4-triazole Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)COC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H21N3O5S/c1-15(2)13-29-23-24-22(17-10-11-19-20(12-17)31-14-30-19)26(25-23)32(27,28)21-9-5-7-16-6-3-4-8-18(16)21/h3-12,15H,13-14H2,1-2H3