2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethylideneamino)ethanamide

Systemtic Name: 2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethylideneamino)ethanamide Openeye Name: 2-[[4-(4-bromophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethylideneamino)acetamide CAS Name: 2-[[4-(4-bromophenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-(1-phenylethylideneamino)acetamide IUPAC Name: 2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethylideneamino)acetamide Traditional Name: 2-[[4-(4-bromophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(1-phenylethylideneamino)acetamide Formula: C23H19BrN6OS MolecularWeight: 507.40556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)Br)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=NNC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)Br)C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H19BrN6OS/c1-16(17-6-3-2-4-7-17)26-27-21(31)15-32-23-29-28-22(18-8-5-13-25-14-18)30(23)20-11-9-19(24)10-12-20/h2-14H,15H2,1H3,(H,27,31)