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

Systemtic Name: 3-(2-chloranyl-4-nitro-phenyl)sulfanyl-5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-chloro-4-nitro-phenyl)sulfanyl-5-(2-methyl-3-furyl)-4-phenyl-1,2,4-triazole CAS Name: 3-[(2-chloro-4-nitrophenyl)thio]-5-(2-methyl-3-furanyl)-4-phenyl-1,2,4-triazole IUPAC Name: 3-(2-chloro-4-nitrophenyl)sulfanyl-5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-nitro-phenyl)thio]-5-(2-methyl-3-furyl)-4-phenyl-1,2,4-triazole Formula: C19H13ClN4O3S MolecularWeight: 412.84952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H13ClN4O3S/c1-12-15(9-10-27-12)18-21-22-19(23(18)13-5-3-2-4-6-13)28-17-8-7-14(24(25)26)11-16(17)20/h2-11H,1H3