3-(furan-2-yl)-4-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(furan-2-yl)-4-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2-furyl)-4-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-furanyl)-4-methyl-5-[1-(3-nitrophenyl)ethylthio]-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-4-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2-furyl)-4-methyl-5-[1-(3-nitrophenyl)ethylthio]-1,2,4-triazole Formula: C15H14N4O3S MolecularWeight: 330.36166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(N2C)C3=CC=CO3

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(N2C)C3=CC=CO3

InChI

InChI=1S/C15H14N4O3S/c1-10(11-5-3-6-12(9-11)19(20)21)23-15-17-16-14(18(15)2)13-7-4-8-22-13/h3-10H,1-2H3