3-(2-chloranyl-4-nitro-phenyl)sulfanyl-4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazole

Systemtic Name: 3-(2-chloranyl-4-nitro-phenyl)sulfanyl-4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Openeye Name: 3-(2-chloro-4-nitro-phenyl)sulfanyl-4-ethyl-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 3-[(2-chloro-4-nitrophenyl)thio]-4-ethyl-5-(2-methyl-3-furanyl)-1,2,4-triazole IUPAC Name: 3-(2-chloro-4-nitrophenyl)sulfanyl-4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-nitro-phenyl)thio]-4-ethyl-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C15H13ClN4O3S MolecularWeight: 364.80672

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=C(OC=C3)C

Isomeric SMILES

CCN1C(=NN=C1SC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=C(OC=C3)C

InChI

InChI=1S/C15H13ClN4O3S/c1-3-19-14(11-6-7-23-9(11)2)17-18-15(19)24-13-5-4-10(20(21)22)8-12(13)16/h4-8H,3H2,1-2H3