1-[2,4-bis(4-chlorophenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone

Systemtic Name: 1-[2,4-bis(4-chlorophenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone Openeye Name: 1-[2,4-bis(4-chlorophenyl)-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone CAS Name: 1-[2,4-bis(4-chlorophenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone IUPAC Name: 1-[2,4-bis(4-chlorophenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone Traditional Name: 1-[2,4-bis(4-chlorophenyl)-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone Formula: C20H15Cl2N3OS MolecularWeight: 416.3236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(N1C2=CC=C(C=C2)Cl)C3=CC=CS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(=O)C1=NN(C(N1C2=CC=C(C=C2)Cl)C3=CC=CS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H15Cl2N3OS/c1-13(26)19-23-25(17-10-6-15(22)7-11-17)20(18-3-2-12-27-18)24(19)16-8-4-14(21)5-9-16/h2-12,20H,1H3