1-(3-methylsulfanylpropyl)-3-[(3-nitrophenyl)amino]thiourea

Systemtic Name: 1-(3-methylsulfanylpropyl)-3-[(3-nitrophenyl)amino]thiourea Openeye Name: 1-(3-methylsulfanylpropyl)-3-(3-nitroanilino)thiourea CAS Name: 1-[3-(methylthio)propyl]-3-(3-nitroanilino)thiourea IUPAC Name: 1-(3-methylsulfanylpropyl)-3-(3-nitroanilino)thiourea Traditional Name: 1-[3-(methylthio)propyl]-3-(3-nitroanilino)thiourea Formula: C11H16N4O2S2 MolecularWeight: 300.40034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)NNC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CSCCCNC(=S)NNC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H16N4O2S2/c1-19-7-3-6-12-11(18)14-13-9-4-2-5-10(8-9)15(16)17/h2,4-5,8,13H,3,6-7H2,1H3,(H2,12,14,18)