5-(furan-2-yl)-2-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine

Systemtic Name: 5-(furan-2-yl)-2-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine Openeye Name: N-benzyl-5-(2-furyl)-2-(p-tolylsulfonyl)-1,2,4-triazol-3-amine CAS Name: 5-(2-furanyl)-2-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine IUPAC Name: N-benzyl-5-(furan-2-yl)-2-(4-methylphenyl)sulfonyl-1,2,4-triazol-3-amine Traditional Name: benzyl-[5-(2-furyl)-2-tosyl-1,2,4-triazol-3-yl]amine Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=CO3)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=CO3)NCC4=CC=CC=C4

InChI

InChI=1S/C20H18N4O3S/c1-15-9-11-17(12-10-15)28(25,26)24-20(21-14-16-6-3-2-4-7-16)22-19(23-24)18-8-5-13-27-18/h2-13H,14H2,1H3,(H,21,22,23)