N-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-methyl-5-[1-(3-nitrophenyl)ethylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-methyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: methyl-[5-[1-(3-nitrophenyl)ethylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C11H12N4O2S2 MolecularWeight: 296.36858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)NC

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)NC

InChI

InChI=1S/C11H12N4O2S2/c1-7(18-11-14-13-10(12-2)19-11)8-4-3-5-9(6-8)15(16)17/h3-7H,1-2H3,(H,12,13)