4-[[5-(2,4-dichlorophenyl)furan-2-yl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[[5-(2,4-dichlorophenyl)furan-2-yl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[[5-(2,4-dichlorophenyl)-2-furyl]methylamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[[5-(2,4-dichlorophenyl)-2-furanyl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[[5-(2,4-dichlorophenyl)furan-2-yl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[[5-(2,4-dichlorophenyl)-2-furyl]methylamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C18H13Cl2N5OS MolecularWeight: 418.29972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C2=CC=C(O2)CNN3C(=NNC3=S)C4=CC=NC=C4

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C2=CC=C(O2)CNN3C(=NNC3=S)C4=CC=NC=C4

InChI

InChI=1S/C18H13Cl2N5OS/c19-12-1-3-14(15(20)9-12)16-4-2-13(26-16)10-22-25-17(23-24-18(25)27)11-5-7-21-8-6-11/h1-9,22H,10H2,(H,24,27)