2-[5-[(3-methoxyphenyl)methylsulfonyl]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]ethanamine

Systemtic Name: 2-[5-[(3-methoxyphenyl)methylsulfonyl]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]ethanamine Openeye Name: 2-[4-isobutyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]ethanamine CAS Name: 2-[5-[(3-methoxyphenyl)methylsulfonyl]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-[5-[(3-methoxyphenyl)methylsulfonyl]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]ethanamine Traditional Name: 2-(4-isobutyl-5-m-anisylsulfonyl-1,2,4-triazol-3-yl)ethylamine Formula: C16H24N4O3S MolecularWeight: 352.45176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1S(=O)(=O)CC2=CC(=CC=C2)OC)CCN

Isomeric SMILES

CC(C)CN1C(=NN=C1S(=O)(=O)CC2=CC(=CC=C2)OC)CCN

InChI

InChI=1S/C16H24N4O3S/c1-12(2)10-20-15(7-8-17)18-19-16(20)24(21,22)11-13-5-4-6-14(9-13)23-3/h4-6,9,12H,7-8,10-11,17H2,1-3H3