N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-(3-nitrophenyl)methanimine

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-(3-nitrophenyl)methanimine Openeye Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-1-(3-nitrophenyl)methanimine CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-(3-nitrophenyl)methanimine IUPAC Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-(3-nitrophenyl)methanimine Traditional Name: (E)-(5-isobutyl-1,3,4-thiadiazol-2-yl)-(3-nitrobenzylidene)amine Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)N=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC1=NN=C(S1)/N=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O2S/c1-9(2)6-12-15-16-13(20-12)14-8-10-4-3-5-11(7-10)17(18)19/h3-5,7-9H,6H2,1-2H3/b14-8+