3-methyl-4-[(E)-[5-(2-nitrophenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-methyl-4-[(E)-[5-(2-nitrophenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-methyl-4-[(E)-[5-(2-nitrophenyl)-2-furyl]methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-methyl-4-[(E)-[5-(2-nitrophenyl)-2-furanyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-methyl-4-[(E)-[5-(2-nitrophenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-methyl-4-[(E)-[5-(2-nitrophenyl)-2-furyl]methyleneamino]-1H-1,2,4-triazole-5-thione Formula: C14H11N5O3S MolecularWeight: 329.33384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1N=CC2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=NNC(=S)N1/N=C/C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O3S/c1-9-16-17-14(23)18(9)15-8-10-6-7-13(22-10)11-4-2-3-5-12(11)19(20)21/h2-8H,1H3,(H,17,23)/b15-8+