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

Systemtic Name: 4-[[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methylamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[[5-(3-chloro-2-methylphenyl)-2-furanyl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[[5-(3-chloro-2-methylphenyl)furan-2-yl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methylamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C19H16ClN5OS MolecularWeight: 397.88124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CC=C(O2)CNN3C(=NNC3=S)C4=CC=NC=C4

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)CNN3C(=NNC3=S)C4=CC=NC=C4

InChI

InChI=1S/C19H16ClN5OS/c1-12-15(3-2-4-16(12)20)17-6-5-14(26-17)11-22-25-18(23-24-19(25)27)13-7-9-21-10-8-13/h2-10,22H,11H2,1H3,(H,24,27)