N-(4-acetamido-3-chloranyl-phenyl)-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-1-phenyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-1-phenyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C21H16ClN5O2S MolecularWeight: 437.90204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H16ClN5O2S/c1-13(28)23-17-10-9-14(12-16(17)22)24-21(29)19-25-20(18-8-5-11-30-18)27(26-19)15-6-3-2-4-7-15/h2-12H,1H3,(H,23,28)(H,24,29)