3-butoxy-5-(4-chlorophenyl)-1-naphthalen-1-ylsulfonyl-1,2,4-triazole

Systemtic Name: 3-butoxy-5-(4-chlorophenyl)-1-naphthalen-1-ylsulfonyl-1,2,4-triazole Openeye Name: 3-butoxy-5-(4-chlorophenyl)-1-(1-naphthylsulfonyl)-1,2,4-triazole CAS Name: 3-butoxy-5-(4-chlorophenyl)-1-(1-naphthalenylsulfonyl)-1,2,4-triazole IUPAC Name: 3-butoxy-5-(4-chlorophenyl)-1-naphthalen-1-ylsulfonyl-1,2,4-triazole Traditional Name: 3-butoxy-5-(4-chlorophenyl)-1-(1-naphthylsulfonyl)-1,2,4-triazole Formula: C22H20ClN3O3S MolecularWeight: 441.9305

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20ClN3O3S/c1-2-3-15-29-22-24-21(17-11-13-18(23)14-12-17)26(25-22)30(27,28)20-10-6-8-16-7-4-5-9-19(16)20/h4-14H,2-3,15H2,1H3