2-ethylsulfonyl-5-(furan-2-yl)-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine

Systemtic Name: 2-ethylsulfonyl-5-(furan-2-yl)-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine Openeye Name: 2-ethylsulfonyl-5-(2-furyl)-N-[(4-isopropylphenyl)methyl]-1,2,4-triazol-3-amine CAS Name: 2-ethylsulfonyl-5-(2-furanyl)-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine IUPAC Name: 2-ethylsulfonyl-5-(furan-2-yl)-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine Traditional Name: [2-esyl-5-(2-furyl)-1,2,4-triazol-3-yl]-(4-isopropylbenzyl)amine Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=CO2)NCC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=CO2)NCC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C18H22N4O3S/c1-4-26(23,24)22-18(20-17(21-22)16-6-5-11-25-16)19-12-14-7-9-15(10-8-14)13(2)3/h5-11,13H,4,12H2,1-3H3,(H,19,20,21)