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

Systemtic Name: 4-[[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[[5-(3-chloro-2-methylphenyl)-2-furanyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[[5-(3-chloro-2-methylphenyl)furan-2-yl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methylamino]-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClN4OS/c1-13-16(8-5-9-17(13)21)18-11-10-15(26-18)12-22-25-19(23-24-20(25)27)14-6-3-2-4-7-14/h2-11,22H,12H2,1H3,(H,24,27)