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

Systemtic Name: 5-(furan-2-yl)-2-methylsulfonyl-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine Openeye Name: 5-(2-furyl)-N-[(4-isopropylphenyl)methyl]-2-methylsulfonyl-1,2,4-triazol-3-amine CAS Name: 5-(2-furanyl)-2-methylsulfonyl-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine IUPAC Name: 5-(furan-2-yl)-2-methylsulfonyl-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine Traditional Name: [5-(2-furyl)-2-mesyl-1,2,4-triazol-3-yl]-(4-isopropylbenzyl)amine Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CNC2=NC(=NN2S(=O)(=O)C)C3=CC=CO3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CNC2=NC(=NN2S(=O)(=O)C)C3=CC=CO3

InChI

InChI=1S/C17H20N4O3S/c1-12(2)14-8-6-13(7-9-14)11-18-17-19-16(15-5-4-10-24-15)20-21(17)25(3,22)23/h4-10,12H,11H2,1-3H3,(H,18,19,20)