(3-chlorophenyl)-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone

Systemtic Name: (3-chlorophenyl)-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone Openeye Name: (3-chlorophenyl)-[3-phenyl-5-(2-thienylmethylamino)-1,2,4-triazol-1-yl]methanone CAS Name: (3-chlorophenyl)-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone IUPAC Name: (3-chlorophenyl)-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone Traditional Name: (3-chlorophenyl)-[3-phenyl-5-(2-thenylamino)-1,2,4-triazol-1-yl]methanone Formula: C20H15ClN4OS MolecularWeight: 394.8773

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CS3)C(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CS3)C(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H15ClN4OS/c21-16-9-4-8-15(12-16)19(26)25-20(22-13-17-10-5-11-27-17)23-18(24-25)14-6-2-1-3-7-14/h1-12H,13H2,(H,22,23,24)