5-(4-chlorophenyl)-N-(furan-2-ylmethyl)-2-(4-methylphenyl)sulfonyl-1,2,4-triazol-3-amine

Systemtic Name: 5-(4-chlorophenyl)-N-(furan-2-ylmethyl)-2-(4-methylphenyl)sulfonyl-1,2,4-triazol-3-amine Openeye Name: 5-(4-chlorophenyl)-N-(2-furylmethyl)-2-(p-tolylsulfonyl)-1,2,4-triazol-3-amine CAS Name: 5-(4-chlorophenyl)-N-(2-furanylmethyl)-2-(4-methylphenyl)sulfonyl-1,2,4-triazol-3-amine IUPAC Name: 5-(4-chlorophenyl)-N-(furan-2-ylmethyl)-2-(4-methylphenyl)sulfonyl-1,2,4-triazol-3-amine Traditional Name: [5-(4-chlorophenyl)-2-tosyl-1,2,4-triazol-3-yl]-(2-furfuryl)amine Formula: C20H17ClN4O3S MolecularWeight: 428.89198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=C(C=C3)Cl)NCC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=C(C=C3)Cl)NCC4=CC=CO4

InChI

InChI=1S/C20H17ClN4O3S/c1-14-4-10-18(11-5-14)29(26,27)25-20(22-13-17-3-2-12-28-17)23-19(24-25)15-6-8-16(21)9-7-15/h2-12H,13H2,1H3,(H,22,23,24)