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

Systemtic Name: 3-(4-methoxyphenyl)-4-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazole Openeye Name: 3-(4-methoxyphenyl)-4-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-4-methyl-5-[1-(3-nitrophenyl)ethylthio]-1,2,4-triazole IUPAC Name: 3-(4-methoxyphenyl)-4-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazole Traditional Name: 3-(4-methoxyphenyl)-4-methyl-5-[1-(3-nitrophenyl)ethylthio]-1,2,4-triazole Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O3S/c1-12(14-5-4-6-15(11-14)22(23)24)26-18-20-19-17(21(18)2)13-7-9-16(25-3)10-8-13/h4-12H,1-3H3