3-(2,4-dichlorophenyl)-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(2,4-dichlorophenyl)-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2,4-dichlorophenyl)-5-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(2,4-dichlorophenyl)-5-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2,4-dichlorophenyl)-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2,4-dichlorophenyl)-5-[(5-pyrrolidinosulfonyl-2-furyl)methylthio]-1,2,4-triazol-4-yl]amine Formula: C17H17Cl2N5O3S2 MolecularWeight: 474.38458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)CSC3=NN=C(N3N)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)CSC3=NN=C(N3N)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C17H17Cl2N5O3S2/c18-11-3-5-13(14(19)9-11)16-21-22-17(24(16)20)28-10-12-4-6-15(27-12)29(25,26)23-7-1-2-8-23/h3-6,9H,1-2,7-8,10,20H2