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

Systemtic Name: 5-(furan-2-yl)-2-(phenylsulfonyl)-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine Openeye Name: 2-(benzenesulfonyl)-5-(2-furyl)-N-[(4-isopropylphenyl)methyl]-1,2,4-triazol-3-amine CAS Name: 2-(benzenesulfonyl)-5-(2-furanyl)-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine IUPAC Name: 2-(benzenesulfonyl)-5-(furan-2-yl)-N-[(4-propan-2-ylphenyl)methyl]-1,2,4-triazol-3-amine Traditional Name: [2-besyl-5-(2-furyl)-1,2,4-triazol-3-yl]-(4-isopropylbenzyl)amine Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CNC2=NC(=NN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CNC2=NC(=NN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C22H22N4O3S/c1-16(2)18-12-10-17(11-13-18)15-23-22-24-21(20-9-6-14-29-20)25-26(22)30(27,28)19-7-4-3-5-8-19/h3-14,16H,15H2,1-2H3,(H,23,24,25)