3-[(2-butoxy-5-ethyl-phenyl)sulfonylmethyl]-6-propan-2-yl-5H-pyrazolo[5,1-c][1,2,4]triazole

Systemtic Name: 3-[(2-butoxy-5-ethyl-phenyl)sulfonylmethyl]-6-propan-2-yl-5H-pyrazolo[5,1-c][1,2,4]triazole Openeye Name: 3-[(2-butoxy-5-ethyl-phenyl)sulfonylmethyl]-6-isopropyl-5H-pyrazolo[5,1-c][1,2,4]triazole CAS Name: 3-[(2-butoxy-5-ethylphenyl)sulfonylmethyl]-6-propan-2-yl-5H-pyrazolo[5,1-c][1,2,4]triazole IUPAC Name: 3-[(2-butoxy-5-ethylphenyl)sulfonylmethyl]-6-propan-2-yl-5H-pyrazolo[5,1-c][1,2,4]triazole Traditional Name: 3-[(2-butoxy-5-ethyl-phenyl)sulfonylmethyl]-6-isopropyl-5H-pyrazolo[5,1-c][1,2,4]triazole Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CC)S(=O)(=O)CC2=NN=C3N2NC(=C3)C(C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CC)S(=O)(=O)CC2=NN=C3N2NC(=C3)C(C)C

InChI

InChI=1S/C20H28N4O3S/c1-5-7-10-27-17-9-8-15(6-2)11-18(17)28(25,26)13-20-22-21-19-12-16(14(3)4)23-24(19)20/h8-9,11-12,14,23H,5-7,10,13H2,1-4H3