3-(2-methylfuran-3-yl)-5-[2-(3-nitrophenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(2-methylfuran-3-yl)-5-[2-(3-nitrophenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2-methyl-3-furyl)-5-[2-(3-nitrophenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(2-methyl-3-furanyl)-5-[2-(3-nitrophenoxy)ethylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2-methylfuran-3-yl)-5-[2-(3-nitrophenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2-methyl-3-furyl)-5-[2-(3-nitrophenoxy)ethylthio]-1,2,4-triazol-4-yl]amine Formula: C15H15N5O4S MolecularWeight: 361.3757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2N)SCCOC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2N)SCCOC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H15N5O4S/c1-10-13(5-6-23-10)14-17-18-15(19(14)16)25-8-7-24-12-4-2-3-11(9-12)20(21)22/h2-6,9H,7-8,16H2,1H3