[2-[[4-[2,5-bis(chloranyl)phenyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-[[4-[2,5-bis(chloranyl)phenyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [2-[[4-(2,5-dichlorophenyl)-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazol-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [2-[[[4-(2,5-dichlorophenyl)-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-[[4-(2,5-dichlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [2-[[[4-(2,5-dichlorophenyl)-5-(2-furyl)-1,2,4-triazol-3-yl]thio]methyl]thiazol-4-yl]-pyrrolidino-methanone Formula: C21H17Cl2N5O2S2 MolecularWeight: 506.42798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=C(C=CC(=C4)Cl)Cl)C5=CC=CO5

Isomeric SMILES

C1CCN(C1)C(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=C(C=CC(=C4)Cl)Cl)C5=CC=CO5

InChI

InChI=1S/C21H17Cl2N5O2S2/c22-13-5-6-14(23)16(10-13)28-19(17-4-3-9-30-17)25-26-21(28)32-12-18-24-15(11-31-18)20(29)27-7-1-2-8-27/h3-6,9-11H,1-2,7-8,12H2